data_2lsh_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 2lsh _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.527 ' C ' ' H ' ' A' ' 14' ' ' THR . 7.8 mp . . . . . 0 C--O 1.234 0.283 0 CA-C-O 120.193 0.044 . . . . 0.0 110.905 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 68.96 -33.4 0.24 Allowed 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.362 0.665 . . . . 0.0 111.536 -177.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.527 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -153.62 -51.36 0.1 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.066 178.146 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.4 m 66.73 -78.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.813 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 52.23 -87.71 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.636 0.585 . . . . 0.0 110.964 -177.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.01 84.62 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.63 174.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -69.18 -25.75 64.5 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.044 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.59 -40.28 66.69 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.942 175.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.83 -35.72 80.84 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 174.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.47 -46.9 88.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.211 174.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.83 -18.28 64.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.739 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.08 -33.92 13.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.87 178.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.66 -24.4 58.5 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.3 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.71 133.47 52.75 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.801 0.334 . . . . 0.0 110.345 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.33 96.55 4.64 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.104 0.478 . . . . 0.0 111.383 -178.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.4 m -142.04 -177.78 5.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.057 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -117.2 157.34 26.17 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.288 -179.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.36 -48.54 72.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -173.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.37 9.37 61.58 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.812 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 m -139.57 31.4 2.08 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.164 0.507 . . . . 0.0 110.034 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.55 HG23 ' O ' ' A' ' 32' ' ' ILE . 0.1 OUTLIER -90.54 127.93 42.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.383 -179.489 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.88 169.11 21.27 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.085 0.469 . . . . 0.0 111.474 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.8 t -125.72 140.12 52.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.194 172.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -121.91 138.99 54.19 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.474 ' HB2' ' HA ' ' A' ' 81' ' ' LEU . 10.1 t30 -116.16 160.18 20.73 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.77 -179.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.91 126.92 3.22 Favored Pre-proline 0 C--O 1.237 0.443 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.111 172.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.449 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 7.9 Cg_endo -49.69 -38.74 46.74 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.909 3.072 . . . . 0.0 114.198 -171.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.74 -23.96 66.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.758 0.313 . . . . 0.0 111.666 -175.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.427 ' HB2' HD21 ' A' ' 36' ' ' ASN . 51.2 mm-40 -96.49 -41.76 8.42 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 0.0 110.27 -178.369 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.0 m -62.44 -33.65 75.24 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.447 0.641 . . . . 0.0 110.468 175.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.449 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.6 OUTLIER -104.13 16.01 27.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.5 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -52.97 -48.58 67.31 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.212 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.979 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 7.4 t70 -94.53 136.12 35.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.885 175.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -27.44 67.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.103 0.478 . . . . 0.0 110.493 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.01 -26.4 29.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.251 178.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.979 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -60.13 -37.06 78.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.331 178.39 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.32 -34.07 70.19 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.09 179.043 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -94.11 -12.91 55.83 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.104 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.592 ' HB3' HD12 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -77.01 -33.98 57.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.022 0.439 . . . . 0.0 110.664 -178.217 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.43 -30.22 63.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.151 0.5 . . . . 0.0 110.748 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.647 ' HA2' ' HG ' ' A' ' 56' ' ' LEU . . . -91.31 60.44 2.97 Favored Glycine 0 N--CA 1.443 -0.898 0 C-N-CA 121.058 -0.592 . . . . 0.0 112.429 -177.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.457 ' HB2' HD12 ' A' ' 72' ' ' LEU . . . -63.81 -24.86 67.92 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.91 0.386 . . . . 0.0 111.034 -178.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -118.12 22.71 9.59 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.542 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.592 ' O ' HG21 ' A' ' 102' ' ' THR . 21.4 tp 66.27 44.18 2.57 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.162 0.506 . . . . 0.0 110.624 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.647 ' HG ' ' HA2' ' A' ' 52' ' ' GLY . 0.2 OUTLIER -86.07 178.28 7.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.091 -177.648 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -120.06 -176.08 3.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.744 -175.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -100.92 -154.36 26.81 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.295 -174.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.558 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 8.2 tp -66.68 140.38 57.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.831 0.316 . . . . 0.0 110.537 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.65 97.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.723 -178.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 103.16 -10.36 54.88 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.875 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.558 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 23.7 t30 -129.27 93.55 3.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.187 0.518 . . . . 0.0 110.85 -178.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 28.6 m -75.1 93.77 2.81 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.712 176.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 173.4 -58.01 0.14 Allowed Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 178.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.44 84.01 5.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.979 0.418 . . . . 0.0 110.208 177.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.63 155.89 29.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.054 177.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.7 m -122.33 131.53 53.95 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.891 0.377 . . . . 0.0 111.422 -177.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.457 ' HB3' HD21 ' A' ' 81' ' ' LEU . . . -105.13 134.57 48.01 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.879 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.825 ' HD2' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -89.2 167.19 13.29 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.703 -174.066 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.719 ' HA ' HD13 ' A' ' 73' ' ' ILE . . . -58.98 -32.87 70.05 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.413 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -37.85 71.2 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.413 0.625 . . . . 0.0 109.519 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.457 HD12 ' HB2' ' A' ' 53' ' ' ALA . 0.1 OUTLIER -65.8 -31.93 73.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.046 175.719 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.719 HD13 ' HA ' ' A' ' 70' ' ' ALA . 3.9 mt -65.37 -35.67 75.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.318 177.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -84.08 -6.49 59.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.064 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.78 -43.86 8.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.292 0.568 . . . . 0.0 109.9 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.2 mp -132.43 -53.87 0.96 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.562 -176.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.18 51.17 2.28 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.034 -179.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.592 HD12 ' HB3' ' A' ' 50' ' ' LEU . 1.9 mm? -54.04 100.45 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 122.683 0.393 . . . . 0.0 111.432 -177.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.522 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -76.17 1.72 15.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.55 -176.426 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.28 -33.64 67.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.917 0.389 . . . . 0.0 110.946 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.474 ' HA ' ' HB2' ' A' ' 36' ' ' ASN . 0.8 OUTLIER -119.61 4.53 11.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.916 0.389 . . . . 0.0 111.431 -176.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 97.0 t -109.0 138.8 34.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.887 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.897 ' HB2' ' HD3' ' A' ' 92' ' ' LYS . 29.2 t70 -123.43 153.19 40.77 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -118.14 132.35 56.35 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.4 0.619 . . . . 0.0 111.586 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.509 HG21 ' HB2' ' A' ' 87' ' ' GLU . 11.7 t -138.66 174.76 10.19 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.812 -1.085 . . . . 0.0 108.111 174.054 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -68.43 -16.79 64.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.336 0.589 . . . . 0.0 110.716 -178.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.509 ' HB2' HG21 ' A' ' 85' ' ' THR . 40.3 mp0 -77.64 -5.48 50.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.553 176.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 114.69 -174.38 15.39 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.188 -0.529 . . . . 0.0 112.652 177.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -65.85 119.75 6.82 Favored 'Trans proline' 0 N--CA 1.463 -0.274 0 C-N-CA 123.037 2.491 . . . . 0.0 111.18 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.423 HG21 HG23 ' A' ' 85' ' ' THR . 3.0 m -133.25 179.91 3.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.921 0.391 . . . . 0.0 111.528 -172.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.57 146.41 50.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.821 177.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.897 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -86.3 -37.52 18.45 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.327 175.424 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -150.57 -87.29 0.07 Allowed 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 120.929 0.395 . . . . 0.0 111.601 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 4.7 mt -92.94 131.27 40.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.563 -169.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.6 p -100.14 132.1 46.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.511 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.437 ' HB2' ' HA ' ' A' ' 107' ' ' ALA . . . -154.33 167.12 31.03 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 120.834 0.35 . . . . 0.0 111.449 -177.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.79 126.35 52.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.019 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.825 ' HB3' ' HD2' ' A' ' 69' ' ' LYS . 11.5 t -135.93 134.35 20.42 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.137 -171.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -82.78 142.75 11.49 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 122.898 2.398 . . . . 0.0 113.042 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -81.23 125.44 30.3 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 169.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 134.72 -113.37 1.13 Allowed Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -175.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.592 HG21 ' O ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -146.85 105.49 3.82 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 117.136 0.468 . . . . 0.0 111.874 179.279 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.494 ' HG1' ' C ' ' A' ' 102' ' ' THR . 0.0 OUTLIER 171.73 168.64 0.1 Allowed 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 124.813 1.245 . . . . 0.0 108.764 172.433 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -80.07 171.45 15.07 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.418 -178.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.417 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.04 143.39 43.13 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.272 -178.822 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 3.7 m -95.26 136.54 25.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.712 -177.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.437 ' HA ' ' HB2' ' A' ' 96' ' ' ALA . . . -111.07 124.14 51.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.058 0.456 . . . . 0.0 111.135 -177.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -105.89 11.27 8.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.273 -178.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.7 t70 . . . . . 0 C--N 1.321 -0.643 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.003 179.575 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.427 HD12 ' HD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.412 0 CA-C-O 121.307 0.575 . . . . 0.0 109.671 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -155.66 -46.81 0.08 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.09 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.95 -22.01 60.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.142 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.425 ' HG ' ' HG2' ' A' ' 89' ' ' PRO . 0.0 OUTLIER -78.68 64.07 3.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.289 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.39 -31.88 70.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.225 0.536 . . . . 0.0 110.409 178.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.76 -31.48 72.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.147 178.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.582 ' HA ' ' NE2' ' A' ' 21' ' ' GLN . 60.2 t80 -66.38 -40.51 89.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.016 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.67 -27.29 50.81 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.144 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -55.67 -43.25 76.17 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.575 0.702 . . . . 0.0 109.212 173.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.582 ' NE2' ' HA ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -56.4 -49.0 75.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.346 -1.297 . . . . 0.0 111.147 175.721 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.92 0.61 43.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.137 -173.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -78.1 -15.08 59.2 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.753 0.311 . . . . 0.0 110.662 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.73 -8.75 55.55 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.93 -0.653 . . . . 0.0 111.806 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.31 173.95 6.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.509 0.195 . . . . 0.0 110.553 -179.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.21 97.11 5.44 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.939 0.4 . . . . 0.0 110.949 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -143.25 155.13 44.42 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.238 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -95.17 170.09 9.64 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.628 0.251 . . . . 0.0 110.635 -176.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.8 p -68.02 126.94 28.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 110.126 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.38 -33.63 5.03 Favored Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -176.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.401 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -94.23 25.97 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.218 0.532 . . . . 0.0 110.324 177.563 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -112.68 130.17 66.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.113 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.439 ' HB1' ' HA ' ' A' ' 69' ' ' LYS . . . -149.75 -179.63 7.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.686 0.755 . . . . 0.0 112.524 -172.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.9 t -123.42 132.96 54.11 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.245 175.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.404 ' HB2' HG12 ' A' ' 94' ' ' ILE . 3.9 m -100.36 121.29 41.27 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.792 HD22 ' HB2' ' A' ' 40' ' ' GLU . 14.3 t30 -113.56 148.0 36.94 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.469 -177.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.412 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 45.4 m -54.1 131.13 59.67 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.437 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.444 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 51.9 Cg_exo -53.27 -37.97 81.32 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.489 2.793 . . . . 0.0 114.157 -171.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.64 -18.02 65.15 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.898 0.38 . . . . 0.0 111.915 -175.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.792 ' HB2' HD22 ' A' ' 36' ' ' ASN . 5.0 mm-40 -102.43 -38.86 7.4 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.8 m -62.49 -30.02 70.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.657 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.444 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.7 OUTLIER -104.72 13.3 31.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.045 -179.655 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -61.23 -42.3 98.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.336 0.589 . . . . 0.0 110.556 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.921 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 30.3 t0 -96.09 130.4 43.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.6 m -69.51 -23.78 63.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.091 0.472 . . . . 0.0 110.315 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -33.39 62.36 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.199 174.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.921 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -64.48 -32.39 74.0 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.416 178.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.2 t -61.65 -22.04 64.93 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.138 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -106.5 -9.87 30.28 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.439 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.679 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 1.1 mp -82.9 -23.33 33.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.921 0.391 . . . . 0.0 110.574 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.34 -29.03 53.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.094 0.474 . . . . 0.0 110.33 176.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -98.43 83.37 0.65 Allowed Glycine 0 N--CA 1.441 -1.015 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.004 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.556 ' HB2' HD11 ' A' ' 72' ' ' LEU . . . -77.41 -6.64 54.12 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.397 0.618 . . . . 0.0 109.944 177.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.3 -126.14 1.27 Allowed Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.023 176.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.466 ' O ' HG23 ' A' ' 102' ' ' THR . 0.0 OUTLIER -107.66 55.35 0.65 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.291 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.939 HD11 ' HZ2' ' A' ' 69' ' ' LYS . 3.3 mt -79.92 169.73 17.48 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.786 -172.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.464 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 19.4 t-20 -131.59 -179.45 5.39 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.94 175.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.549 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -99.81 -133.24 8.03 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.847 -175.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.765 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 7.9 tp -80.23 152.64 29.0 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.05 89.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.188 0.518 . . . . 0.0 111.152 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.27 -2.27 57.7 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.7 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.765 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 47.4 t30 -124.86 102.28 7.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.018 0.437 . . . . 0.0 110.877 -178.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.42 73.98 6.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.15 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.58 -55.73 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.909 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.64 79.47 4.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.03 0.443 . . . . 0.0 110.823 178.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.549 ' HA ' ' HA2' ' A' ' 58' ' ' GLY . . . -74.72 124.89 27.58 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 173.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.8 m -110.62 128.79 55.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.11 0.481 . . . . 0.0 110.271 -175.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.525 ' H ' HD11 ' A' ' 81' ' ' LEU . . . -106.21 144.65 32.61 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.804 -174.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.939 ' HZ2' HD11 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -103.51 -174.92 2.66 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.38 -175.424 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.71 -28.57 63.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.565 -178.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.425 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -63.95 -42.31 97.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.468 0.651 . . . . 0.0 110.233 177.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.556 HD11 ' HB2' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -77.26 -35.89 54.87 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.823 -179.95 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.454 HG12 HG22 ' A' ' 82' ' ' VAL . 3.5 mt -65.54 -37.25 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.358 -179.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -72.91 -41.32 64.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.929 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.425 ' HB2' ' O ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -76.4 -53.19 8.51 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.328 -173.468 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.498 ' HA ' HD11 ' A' ' 76' ' ' LEU . 0.5 OUTLIER -106.19 -44.52 4.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.25 -172.839 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.94 50.24 7.07 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.194 -1.003 . . . . 0.0 112.504 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.486 HD13 ' HB2' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -62.59 106.01 0.72 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 122.332 0.253 . . . . 0.0 111.362 -179.709 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.01 -6.53 39.61 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.891 -177.228 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.776 ' HB3' HD13 ' A' ' 47' ' ' LEU . . . -86.74 -13.75 44.36 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.906 0.384 . . . . 0.0 110.387 177.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.525 HD11 ' H ' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -108.62 -33.96 6.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.083 -176.331 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.454 HG22 HG12 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -108.46 137.32 40.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.69 179.805 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.403 ' O ' ' HA ' ' A' ' 89' ' ' PRO . 11.3 t70 -98.18 176.01 5.88 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 175.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.91 112.19 7.32 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.946 0.403 . . . . 0.0 111.285 -175.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.798 ' HG1' HG21 ' A' ' 90' ' ' VAL . 1.2 p -118.82 -167.64 1.41 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.802 177.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.465 ' OE1' ' HB ' ' A' ' 85' ' ' THR . 0.0 OUTLIER -66.16 -33.27 75.39 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 177.588 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -80.02 4.8 15.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.437 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 103.8 -155.48 17.75 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.764 173.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.425 ' HG2' ' HG ' ' A' ' 15' ' ' SER . 73.2 Cg_endo -73.4 126.13 10.73 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.876 2.384 . . . . 0.0 111.27 177.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.798 HG21 ' HG1' ' A' ' 85' ' ' THR . 0.0 OUTLIER -133.12 175.07 12.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.29 -173.137 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.07 116.96 9.29 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.997 178.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.5 tttp -76.19 -25.11 54.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.279 0.562 . . . . 0.0 110.433 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -133.02 -106.21 0.25 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.861 -176.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.404 HG12 ' HB2' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -113.69 149.11 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.831 0.348 . . . . 0.0 111.042 -174.18 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.422 ' H ' HG21 ' A' ' 95' ' ' VAL . 1.5 t -80.87 144.75 10.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.556 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -154.2 170.2 21.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.03 0.443 . . . . 0.0 111.763 -177.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.6 m -124.33 108.42 12.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.0 177.244 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.539 ' HB2' ' CD ' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -127.85 141.71 42.0 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.243 -174.017 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -87.81 154.57 7.38 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.165 2.576 . . . . 0.0 113.099 -179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.461 ' CD ' ' HZ1' ' A' ' 69' ' ' LYS . 3.6 tp10 -98.26 117.62 33.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.401 173.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.455 ' C ' ' HG1' ' A' ' 102' ' ' THR . . . 145.06 -67.78 0.42 Allowed Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.008 177.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.466 HG23 ' O ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -157.4 177.33 11.55 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.693 HG22 ' H ' ' A' ' 104' ' ' ASN . 1.4 m 69.79 167.59 0.29 Allowed 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.603 0.716 . . . . 0.0 111.919 177.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.693 ' H ' HG22 ' A' ' 103' ' ' THR . 4.5 p30 -89.88 -179.29 5.69 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.542 -171.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.537 ' HB2' ' HB3' ' A' ' 98' ' ' CYS . 7.2 t -112.79 148.69 34.29 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.745 -175.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.532 HG21 ' O ' ' A' ' 106' ' ' VAL . 2.0 m -104.26 138.34 29.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.953 0.406 . . . . 0.0 110.204 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.86 117.79 27.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.817 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -121.49 26.41 3.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.953 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.1 t70 . . . . . 0 C--O 1.235 0.33 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.006 176.892 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.697 ' HG ' ' HB1' ' A' ' 70' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.374 0 CA-C-O 121.434 0.635 . . . . 0.0 109.97 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.04 -8.7 59.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.608 -177.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.48 6.82 8.94 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.929 0.395 . . . . 0.0 111.559 -177.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 m -61.97 -50.6 71.46 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.422 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 60.72 -73.44 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.743 0.652 . . . . 0.0 112.071 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.5 -28.66 69.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.566 -178.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -62.9 -38.61 91.63 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.183 0.516 . . . . 0.0 110.257 176.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -71.58 -22.06 61.78 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.837 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.462 ' HA ' ' HG2' ' A' ' 23' ' ' GLU . 16.9 mtpp -75.65 -22.25 56.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.723 0.773 . . . . 0.0 109.052 178.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -82.3 -41.95 19.45 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.522 173.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.69 -17.34 60.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.988 -1.005 . . . . 0.0 112.266 -175.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.462 ' HG2' ' HA ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -77.17 -9.2 58.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.675 0.274 . . . . 0.0 111.039 179.228 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.72 -20.04 58.8 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.669 -0.776 . . . . 0.0 112.216 177.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -125.48 123.29 38.88 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.15 97.67 1.23 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.268 0.556 . . . . 0.0 111.945 -176.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.3 m -140.85 152.52 45.18 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 173.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -84.2 153.93 23.36 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -173.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.05 -40.99 84.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -176.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.0 -8.86 86.95 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.528 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.1 10.06 12.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.033 0.444 . . . . 0.0 110.803 -178.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.467 ' O ' HG21 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -90.24 137.94 20.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.445 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . . . -149.64 -178.69 6.58 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -170.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.55 ' HB3' HD13 ' A' ' 81' ' ' LEU . 4.4 t -144.43 142.15 30.11 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.278 173.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.809 ' HB2' ' HB ' ' A' ' 94' ' ' ILE . 78.6 m -113.86 158.32 21.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.839 0.352 . . . . 0.0 110.401 179.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -145.26 150.72 37.17 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -42.96 139.45 2.15 Favored Pre-proline 0 C--O 1.235 0.33 0 O-C-N 123.733 0.646 . . . . 0.0 112.436 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.508 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 70.4 Cg_exo -51.22 -54.6 5.13 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.596 2.864 . . . . 0.0 113.881 -172.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.9 -7.7 23.9 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -172.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -100.56 -51.36 3.63 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.771 0.32 . . . . 0.0 110.718 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.3 m -68.35 -33.3 74.03 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.388 0.613 . . . . 0.0 110.606 178.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.508 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.3 m-80 -101.34 14.38 32.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.654 -178.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -61.31 -41.91 97.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.379 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.825 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 35.5 t70 -94.96 140.27 30.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.558 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -42.05 97.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.183 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.35 -33.55 73.26 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.862 0.363 . . . . 0.0 110.38 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.825 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -59.9 -36.77 77.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.772 177.415 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.34 -23.28 66.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.933 0.396 . . . . 0.0 110.981 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -98.5 -7.02 56.23 Favored Glycine 0 C--N 1.329 0.189 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.496 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.604 HD11 HD22 ' A' ' 76' ' ' LEU . 2.6 tt -82.3 -31.25 30.07 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.009 0.433 . . . . 0.0 110.43 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.521 HD22 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -75.83 -16.23 60.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.881 179.003 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.56 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -113.81 77.99 0.25 Allowed Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 120.957 -0.64 . . . . 0.0 112.225 -176.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.515 ' HB1' HD11 ' A' ' 72' ' ' LEU . . . -78.95 54.06 1.51 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.243 0.544 . . . . 0.0 110.412 177.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.01 -117.74 1.04 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 -177.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.9 mt -117.6 49.14 1.25 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.252 0.549 . . . . 0.0 109.778 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.56 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 1.0 OUTLIER -82.72 175.84 9.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.275 -171.362 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.552 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 6.2 t-20 -135.86 -178.79 5.29 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.299 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -111.79 -132.12 5.87 Favored Glycine 0 C--N 1.315 -0.606 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 -177.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.451 HD23 ' HA ' ' A' ' 59' ' ' LEU . 0.1 OUTLIER -66.42 149.8 49.86 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 175.684 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.412 ' HG ' ' C ' ' A' ' 105' ' ' CYS . 74.4 m -65.43 89.72 0.1 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.139 0.495 . . . . 0.0 110.957 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.1 -37.24 3.85 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.604 178.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -89.69 98.62 11.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.912 0.387 . . . . 0.0 111.332 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.69 72.16 2.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.152 179.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -169.76 -51.37 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 111.188 -0.765 . . . . 0.0 111.188 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.02 77.73 6.7 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.043 0.449 . . . . 0.0 110.533 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.51 142.45 40.88 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.76 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 4.6 m -123.11 148.41 45.7 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.374 -0.531 . . . . 0.0 111.081 -174.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.51 ' CB ' HD13 ' A' ' 78' ' ' LEU . . . -107.59 139.26 42.4 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.27 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.743 ' HE3' HD21 ' A' ' 72' ' ' LEU . 0.0 OUTLIER -94.3 167.38 11.57 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.402 179.763 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.697 ' HB1' ' HG ' ' A' ' 12' ' ' LEU . . . -59.73 -30.69 69.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.058 0.456 . . . . 0.0 110.083 176.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -27.02 68.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.885 176.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.743 HD21 ' HE3' ' A' ' 69' ' ' LYS . 1.1 tp -91.14 -24.9 19.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.893 0.378 . . . . 0.0 110.733 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 76.2 mt -72.75 -29.17 29.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 172.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.11 -12.82 59.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.006 172.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.578 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 1.1 tp-100 -93.97 -45.31 7.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.342 -178.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.604 HD22 HD11 ' A' ' 50' ' ' LEU . 2.0 mp -120.28 -41.94 2.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.688 -174.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.61 50.03 3.25 Favored Glycine 0 CA--C 1.515 0.087 0 C-N-CA 120.105 -1.045 . . . . 0.0 112.13 -178.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.51 HD13 ' CB ' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -81.56 164.19 22.1 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.699 0.285 . . . . 0.0 111.64 -175.519 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.61 ' HA ' HG23 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -122.56 -0.83 9.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.977 -177.892 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.56 -35.46 68.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -173.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.55 HD13 ' HB3' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -116.67 27.07 9.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.761 0.315 . . . . 0.0 111.118 -176.734 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.61 HG23 ' HA ' ' A' ' 79' ' ' LEU . 2.0 t -119.21 137.12 54.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.466 178.278 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.911 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 2.6 t70 -124.13 177.4 5.83 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.987 0.422 . . . . 0.0 111.602 -176.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -56.82 133.4 54.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.853 -175.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.594 ' HB ' HG21 ' A' ' 90' ' ' VAL . 5.7 t -159.32 150.28 19.78 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.106 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -108.53 -19.57 13.4 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.951 0.405 . . . . 0.0 110.474 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -90.36 -46.44 8.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.463 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 174.14 149.3 6.97 Favored Glycine 0 N--CA 1.444 -0.798 0 N-CA-C 111.219 -0.752 . . . . 0.0 111.219 -177.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.55 ' HA ' HG23 ' A' ' 85' ' ' THR . 88.8 Cg_exo -45.61 126.85 9.17 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 123.812 3.008 . . . . 0.0 113.393 -173.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.594 HG21 ' HB ' ' A' ' 85' ' ' THR . 8.7 m -127.43 -179.81 3.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.409 -176.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.76 135.06 52.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.069 -177.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.911 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.5 tttp -85.77 -28.28 24.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.489 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.42 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -148.21 -92.2 0.08 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -169.696 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.809 ' HB ' ' HB2' ' A' ' 35' ' ' CYS . 8.7 mt -101.16 117.15 46.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.091 -168.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.5 t -73.95 125.99 33.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.231 -0.44 . . . . 0.0 109.971 176.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -154.54 176.6 12.19 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.001 -176.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 53.6 m -128.13 127.57 43.27 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.218 177.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.76 ' SG ' ' HB2' ' A' ' 67' ' ' CYS . 19.2 m -120.72 137.37 26.3 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.394 -174.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -86.33 155.16 9.41 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 122.428 2.086 . . . . 0.0 111.475 170.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.69 156.04 17.55 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 173.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 97.49 -71.55 0.7 Allowed Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.368 -178.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -150.55 172.03 16.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.511 0.196 . . . . 0.0 111.528 -176.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 74.48 168.04 0.29 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.644 0.778 . . . . 0.0 113.052 172.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.552 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.4 OUTLIER -95.35 178.37 5.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.79 -1.095 . . . . 0.0 112.145 -170.239 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.412 ' C ' ' HG ' ' A' ' 60' ' ' SER . 4.4 m -112.89 142.65 45.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.875 -176.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -90.76 148.99 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 174.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -107.04 140.98 38.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.595 0.236 . . . . 0.0 111.098 -176.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -129.81 20.45 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.826 0.346 . . . . 0.0 111.266 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.377 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 176.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.751 ' HB2' ' HG ' ' A' ' 15' ' ' SER . 5.0 mp . . . . . 0 N--CA 1.465 0.285 0 CA-C-O 120.589 0.233 . . . . 0.0 110.564 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.53 38.73 30.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.249 -179.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 58.76 50.14 9.14 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.68 -174.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.751 ' HG ' ' HB2' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -51.99 -52.54 49.84 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.597 -176.408 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.3 -56.64 0.44 Allowed 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.575 0.75 . . . . 0.0 111.599 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.9 -35.71 81.39 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.017 0.437 . . . . 0.0 110.919 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -68.87 -25.12 64.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.479 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.51 -24.24 60.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.458 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -67.98 -29.8 68.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 176.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.29 -27.66 59.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.406 -1.27 . . . . 0.0 110.519 177.274 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.12 -18.83 62.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.682 -176.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.06 -8.11 13.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.029 0.442 . . . . 0.0 110.563 175.046 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -83.44 -24.94 49.22 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.496 -0.859 . . . . 0.0 111.116 175.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.38 135.01 48.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -74.73 96.91 3.12 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.017 0.437 . . . . 0.0 111.592 -176.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 60.9 m -145.47 136.05 24.27 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 175.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -69.14 144.41 53.86 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.471 -0.196 . . . . 0.0 110.471 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 t -62.95 -36.67 76.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.691 0.282 . . . . 0.0 111.255 -178.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.54 -7.98 88.0 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.999 -0.619 . . . . 0.0 112.289 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.21 38.72 3.13 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.948 0.404 . . . . 0.0 110.133 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.5 tt -99.06 134.43 38.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.533 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -147.97 171.54 15.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.127 0.489 . . . . 0.0 111.585 -172.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.47 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 2.0 t -120.28 145.65 46.87 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.076 172.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -128.68 157.61 40.87 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -176.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.453 ' HB2' ' CD1' ' A' ' 81' ' ' LEU . 10.6 t-20 -151.26 160.42 43.82 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 -177.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.52 146.79 23.01 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.011 176.103 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.595 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 10.7 Cg_endo -54.08 -38.13 87.09 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.154 2.569 . . . . 0.0 112.976 -176.198 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.5 -13.97 62.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.966 0.413 . . . . 0.0 111.717 -175.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -103.39 -50.11 3.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.638 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 22.7 m -59.76 -36.83 77.46 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.795 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.595 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.9 m-80 -104.8 16.93 25.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.029 -176.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -56.03 -27.68 54.2 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.725 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.995 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 12.2 t70 -116.17 133.28 56.19 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 172.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 17.2 m -66.88 -21.21 66.01 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -176.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.1 tp -91.09 -25.3 19.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.245 0.545 . . . . 0.0 110.12 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.995 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 3.1 tp -61.57 -37.63 84.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.47 -177.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.696 ' HA ' HD23 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -64.64 -20.14 66.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.91 -177.084 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -95.96 -9.73 56.95 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.045 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.562 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 2.0 mp -85.82 -26.07 25.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.825 0.345 . . . . 0.0 111.154 -177.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.711 ' HA ' HD21 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -80.03 -11.11 59.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.939 0.4 . . . . 0.0 111.744 -175.646 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.627 ' HA3' ' CB ' ' A' ' 56' ' ' LEU . . . -128.05 91.28 0.34 Allowed Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.808 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.517 ' HB2' HD13 ' A' ' 72' ' ' LEU . . . -77.91 74.68 4.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.258 0.551 . . . . 0.0 110.648 -178.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 159.49 -69.53 0.25 Allowed Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.136 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.2 tp -136.54 -40.72 0.63 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.627 ' CB ' ' HA3' ' A' ' 52' ' ' GLY . 0.1 OUTLIER 69.13 134.34 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 122.435 1.112 . . . . 0.0 112.672 178.603 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.557 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 8.8 t-20 -141.44 -178.8 5.79 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 114.202 -1.363 . . . . 0.0 107.9 171.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.669 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -114.97 -145.44 8.71 Favored Glycine 0 C--N 1.312 -0.768 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.62 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.438 ' HB3' ' HB2' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -65.2 156.28 32.33 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.469 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.7 m -52.28 101.94 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.099 0.476 . . . . 0.0 111.726 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 74.67 18.63 80.04 Favored Glycine 0 C--N 1.338 0.663 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.529 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.438 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 4.1 t30 -123.29 94.52 4.28 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.866 0.365 . . . . 0.0 110.795 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.06 99.67 7.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.065 0.459 . . . . 0.0 111.051 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 155.7 -55.37 0.41 Allowed Glycine 0 CA--C 1.508 -0.348 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 177.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.78 84.15 6.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.954 0.407 . . . . 0.0 109.999 175.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.669 ' HA ' ' HA2' ' A' ' 58' ' ' GLY . . . -90.54 150.81 21.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.936 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 m -124.26 136.34 54.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.972 0.415 . . . . 0.0 111.195 -174.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.725 ' HB3' HD21 ' A' ' 81' ' ' LEU . . . -105.63 139.23 40.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.95 178.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -95.54 168.24 10.81 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.732 -173.885 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.49 -33.32 73.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.047 0.451 . . . . 0.0 111.026 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -31.01 71.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.331 0.586 . . . . 0.0 110.173 177.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.517 HD13 ' HB2' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -79.73 -21.65 44.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.686 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.94 -41.5 89.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.368 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -90.22 -0.44 57.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.461 . . . . 0.0 110.746 179.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.79 -52.95 4.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.535 178.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.562 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 1.1 mm? -118.67 -46.22 2.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.131 -177.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 101.97 52.54 1.01 Allowed Glycine 0 CA--C 1.519 0.315 0 C-N-CA 119.724 -1.227 . . . . 0.0 113.388 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.711 HD21 ' HA ' ' A' ' 51' ' ' LEU . 3.9 mm? -64.48 92.34 0.09 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.989 0.424 . . . . 0.0 111.736 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.8 -11.65 60.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.686 -178.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.593 ' HB1' HD21 ' A' ' 47' ' ' LEU . . . -84.24 -15.46 46.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.174 0.511 . . . . 0.0 110.621 178.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.725 HD21 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -108.37 -16.35 14.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.622 -176.258 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.33 137.85 46.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.187 0.518 . . . . 0.0 110.976 -178.037 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.618 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 3.2 t70 -113.85 176.91 4.83 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 176.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -135.19 124.7 24.99 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -171.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.15 -169.34 1.63 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.988 -1.006 . . . . 0.0 108.962 171.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.02 -29.15 61.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.849 0.357 . . . . 0.0 110.778 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.542 ' HB3' ' O ' ' A' ' 15' ' ' SER . 35.3 mp0 -76.6 -14.52 59.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.621 -178.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 135.51 -165.52 24.73 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 119.964 -1.113 . . . . 0.0 112.728 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -74.49 125.6 9.71 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.88 2.386 . . . . 0.0 111.802 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.502 ' H ' HG23 ' A' ' 90' ' ' VAL . 0.7 OUTLIER -124.15 -177.96 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.079 -176.699 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.28 129.93 40.65 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 178.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.618 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 11.8 tttp -79.74 -27.69 40.54 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.639 -176.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -155.02 -90.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -172.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 5.2 mt -95.63 138.66 20.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.002 -171.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.6 t -101.67 123.09 54.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.586 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.15 157.92 43.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.909 -177.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.36 124.26 49.25 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 177.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.448 ' CA ' ' HB3' ' A' ' 105' ' ' CYS . 8.3 t -135.45 133.03 20.12 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.188 -171.172 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.406 ' O ' ' HD2' ' A' ' 69' ' ' LYS . 36.9 Cg_endo -65.84 171.77 9.35 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.755 2.304 . . . . 0.0 111.683 174.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.63 -82.49 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -171.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -128.02 0.76 6.67 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.064 -1.065 . . . . 0.0 113.413 -174.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.03 142.32 51.57 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.682 0.241 . . . . 0.0 111.511 -175.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 6.3 m 73.59 157.32 0.19 Allowed 'General case' 0 CA--C 1.532 0.286 0 O-C-N 123.882 0.739 . . . . 0.0 112.304 175.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.557 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.7 OUTLIER -73.11 168.9 18.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.762 -175.374 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.448 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -113.22 141.82 46.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.027 -179.403 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -83.3 145.99 7.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.065 174.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.94 115.69 23.02 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.458 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.447 ' H ' HG22 ' A' ' 108' ' ' VAL . 0.1 OUTLIER -85.89 -8.63 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-O 121.837 0.827 . . . . 0.0 110.071 177.563 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.308 -1.222 0 CA-C-N 114.315 -1.311 . . . . 0.0 108.512 176.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.469 0.506 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.3 -34.86 78.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.709 0.29 . . . . 0.0 111.39 179.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.71 -20.15 47.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.81 0.338 . . . . 0.0 111.641 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.674 ' HA ' ' O ' ' A' ' 87' ' ' GLU . 0.3 OUTLIER -76.19 68.15 2.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.211 0.529 . . . . 0.0 111.317 179.295 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.75 -19.9 66.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.851 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -82.04 -26.89 33.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.503 177.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.539 ' O ' ' HB2' ' A' ' 21' ' ' GLN . 41.2 t80 -82.73 -41.55 19.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.758 -178.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.76 -18.91 61.66 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.7 mttp -67.33 -18.01 64.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.014 0.435 . . . . 0.0 110.533 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -63.69 -28.1 69.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.562 177.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.05 -18.56 62.56 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.406 -178.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -98.35 -41.53 7.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.487 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -66.41 -30.33 76.39 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.679 177.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.62 123.02 24.32 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 176.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.79 97.64 1.82 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.02 0.438 . . . . 0.0 111.464 -176.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 79.8 m -139.51 -178.43 5.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.653 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.674 ' H ' ' HB2' ' A' ' 31' ' ' SER . 30.0 t-20 -122.03 176.61 5.71 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 -176.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.625 HG22 ' H ' ' A' ' 30' ' ' GLY . 2.5 m -52.76 -53.49 20.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -178.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.625 ' H ' HG22 ' A' ' 29' ' ' VAL . . . -89.41 20.62 33.21 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.961 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.674 ' HB2' ' H ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -123.61 -12.2 7.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.849 0.357 . . . . 0.0 110.839 177.044 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.411 ' O ' HG21 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -82.22 127.26 39.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 175.684 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.72 153.99 38.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.152 0.501 . . . . 0.0 111.462 -174.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 11.5 t -122.7 143.06 50.04 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.628 176.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -127.54 163.83 23.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.605 0.716 . . . . 0.0 110.985 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.458 ' HB2' ' HA ' ' A' ' 81' ' ' LEU . 20.2 t-20 -136.14 160.82 37.51 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.19 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -45.8 137.07 5.99 Favored Pre-proline 0 C--N 1.329 -0.292 0 O-C-N 123.588 0.555 . . . . 0.0 110.457 177.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.491 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 79.7 Cg_exo -48.54 -36.84 32.58 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 123.254 2.636 . . . . 0.0 113.351 -175.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.02 -7.82 50.99 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -177.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -109.18 -41.78 4.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.127 0.489 . . . . 0.0 109.86 178.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 29.0 m -65.45 -37.05 85.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.671 175.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.491 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.3 m-80 -100.27 15.31 28.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.707 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -65.11 -32.75 74.61 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.474 -176.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.933 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.6 t70 -104.8 146.6 28.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.636 178.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.86 -36.94 75.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.002 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.3 tp -86.47 -20.89 27.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.134 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.933 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -53.73 -47.54 70.49 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.109 0.481 . . . . 0.0 111.203 179.047 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.59 -18.24 65.26 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.22 -178.304 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -93.98 -29.13 10.04 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.737 176.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.9 mt -74.11 -24.53 59.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 176.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -51.8 66.02 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.691 173.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -87.02 74.23 2.35 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.842 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.582 ' HB2' HD23 ' A' ' 72' ' ' LEU . . . -100.9 32.92 2.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.593 0.711 . . . . 0.0 109.334 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 160.73 -111.88 0.5 Allowed Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.51 -174.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.605 HD12 ' HA2' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -117.15 72.33 0.83 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.364 0.602 . . . . 0.0 110.392 176.896 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.944 ' HG ' ' HZ2' ' A' ' 69' ' ' LYS . 1.5 mp -123.44 134.1 53.98 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.253 178.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -128.42 -177.34 4.13 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.297 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.72 -162.83 35.06 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.617 -0.802 . . . . 0.0 113.073 -173.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.507 HD12 ' H ' ' A' ' 60' ' ' SER . 0.4 OUTLIER -65.35 158.2 27.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.508 0.194 . . . . 0.0 110.494 -179.679 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.977 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -61.07 88.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.464 0.65 . . . . 0.0 112.283 -177.638 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.03 4.1 78.76 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.454 -0.794 . . . . 0.0 113.11 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.4 t30 -117.66 134.6 54.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 117.123 0.461 . . . . 0.0 111.422 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.0 125.99 47.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.407 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.11 -49.37 0.93 Allowed Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.856 -0.687 . . . . 0.0 111.752 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.401 ' HB2' HD21 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -82.56 115.5 21.57 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 175.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -127.77 147.34 50.41 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.265 179.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.9 m -121.08 135.63 55.15 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.909 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.723 ' HB1' HD12 ' A' ' 81' ' ' LEU . . . -105.82 152.45 23.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 176.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.944 ' HZ2' ' HG ' ' A' ' 56' ' ' LEU . 0.0 OUTLIER -111.62 -177.2 3.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.385 -176.956 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.3 -24.5 67.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.073 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.413 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -66.77 -31.02 71.38 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.417 0.627 . . . . 0.0 110.027 178.773 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.771 HD22 HD11 ' A' ' 56' ' ' LEU . 0.1 OUTLIER -90.43 -33.72 15.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.709 179.632 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.1 mt -65.87 -39.45 84.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.597 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -84.48 -2.97 58.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.899 0.381 . . . . 0.0 110.841 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -94.75 -53.31 3.91 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.052 0.453 . . . . 0.0 110.823 178.38 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 76' ' ' LEU . 0.4 OUTLIER -126.28 -28.57 3.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.804 -175.339 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.04 50.69 4.49 Favored Glycine 0 C--O 1.228 -0.274 0 C-N-CA 120.343 -0.932 . . . . 0.0 111.929 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.484 ' HA ' HD22 ' A' ' 78' ' ' LEU . 2.6 mt -59.19 96.15 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.766 0.426 . . . . 0.0 111.944 -176.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.509 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -79.17 6.26 10.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.414 -177.15 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.97 -26.47 64.11 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.255 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.723 HD12 ' HB1' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -129.9 2.1 4.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.714 -176.292 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 39.0 t -111.69 138.25 41.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.12 0.486 . . . . 0.0 110.97 -175.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.408 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 3.3 t70 -123.87 177.31 5.81 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.427 176.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -136.2 137.74 41.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.048 0.451 . . . . 0.0 112.202 -172.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.519 ' HG1' HG21 ' A' ' 90' ' ' VAL . 0.6 OUTLIER -135.56 -169.3 2.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.669 174.122 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -42.93 99.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.145 0.497 . . . . 0.0 109.968 177.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.674 ' O ' ' HA ' ' A' ' 15' ' ' SER . 3.1 mp0 -81.57 43.29 0.74 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.47 -179.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 80.89 -170.37 52.97 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.974 -0.557 . . . . 0.0 113.52 173.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.446 ' O ' ' HB3' ' A' ' 15' ' ' SER . 11.0 Cg_exo -70.84 134.5 25.84 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 123.072 2.514 . . . . 0.0 111.369 174.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.519 HG21 ' HG1' ' A' ' 85' ' ' THR . 0.6 OUTLIER -132.81 -153.6 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.66 -174.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -94.45 152.87 18.26 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.428 -178.036 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.408 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 1.1 tttt -92.92 -34.82 13.63 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.29 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -159.12 -62.4 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 33.3 mt -112.27 132.6 60.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.905 0.383 . . . . 0.0 111.809 -171.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.514 ' H ' HG12 ' A' ' 95' ' ' VAL . 0.2 OUTLIER -105.16 139.02 27.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.489 175.824 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.411 ' CB ' ' HA ' ' A' ' 107' ' ' ALA . . . -149.94 167.57 26.29 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 121.22 0.534 . . . . 0.0 111.859 -176.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 4.2 t -112.46 114.71 27.54 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.103 176.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.621 ' O ' ' HA ' ' A' ' 31' ' ' SER . 46.8 t -135.05 106.72 10.39 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.799 -174.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.763 ' HD2' HG22 ' A' ' 102' ' ' THR . 25.9 Cg_exo -67.54 144.83 68.34 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.958 2.439 . . . . 0.0 112.251 173.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.633 ' HA ' ' HZ3' ' A' ' 69' ' ' LYS . 0.3 OUTLIER -77.32 72.03 3.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.494 0.664 . . . . 0.0 109.802 171.919 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.605 ' HA2' HD12 ' A' ' 55' ' ' LEU . . . 145.11 63.46 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.313 -177.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.763 HG22 ' HD2' ' A' ' 99' ' ' PRO . 12.0 t -148.29 156.69 42.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.943 0.401 . . . . 0.0 111.061 -176.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -38.54 87.18 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.521 177.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.977 ' HB2' ' HA ' ' A' ' 60' ' ' SER . 0.2 OUTLIER -155.14 159.49 40.22 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.735 176.589 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.46 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 1.8 m -111.63 140.39 46.28 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 176.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -96.74 136.81 26.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.235 0.541 . . . . 0.0 111.477 -175.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.411 ' HA ' ' CB ' ' A' ' 96' ' ' ALA . . . -90.83 130.04 36.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.924 176.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -95.22 -6.26 10.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.423 0.63 . . . . 0.0 111.013 -179.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.7 t70 . . . . . 0 C--N 1.316 -0.861 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.389 175.893 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.446 ' HB2' ' HB3' ' A' ' 15' ' ' SER . 5.2 mp . . . . . 0 CA--C 1.529 0.163 0 CA-C-O 120.014 -0.041 . . . . 0.0 110.983 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 36.82 74.05 0.08 Allowed 'General case' 0 N--CA 1.472 0.636 0 O-C-N 124.144 0.903 . . . . 0.0 112.986 175.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.27 62.71 1.14 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.602 0.715 . . . . 0.0 111.083 -177.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.446 ' HB3' ' HB2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -85.25 49.69 1.8 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.135 -177.316 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.67 -51.44 49.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.49 -33.08 70.89 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.479 176.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.564 ' HB2' HG13 ' A' ' 90' ' ' VAL . 23.7 t80 -70.25 -47.1 62.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.056 0.455 . . . . 0.0 110.335 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.8 -23.98 64.35 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.915 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -67.9 -25.08 65.31 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.847 0.832 . . . . 0.0 109.254 177.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.11 -38.16 11.75 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.409 -1.268 . . . . 0.0 110.601 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.73 -17.81 64.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.97 -176.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.62 -8.02 57.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.939 0.399 . . . . 0.0 110.677 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.31 1.72 37.45 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.802 -0.714 . . . . 0.0 111.44 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.578 HG21 HG23 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -114.65 124.55 52.12 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.297 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.43 94.59 2.1 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.08 0.467 . . . . 0.0 111.06 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.462 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 27.7 m -151.85 -177.53 6.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.036 179.052 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -112.7 151.32 30.36 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 176.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.9 t -58.29 -40.89 79.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.917 0.389 . . . . 0.0 111.066 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.51 8.33 54.58 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.486 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -143.58 32.46 1.3 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.944 0.402 . . . . 0.0 110.312 178.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.465 ' O ' HG21 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -95.9 134.86 31.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.678 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.57 ' HB3' ' HB3' ' A' ' 98' ' ' CYS . . . -149.2 170.88 17.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.254 0.549 . . . . 0.0 111.974 -175.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.2 t -118.26 141.87 48.07 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.829 173.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -126.17 156.29 40.39 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.398 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -156.2 160.37 39.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.172 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.583 ' HB2' ' OE1' ' A' ' 40' ' ' GLU . 1.5 m -59.61 148.45 74.64 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.069 -177.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.568 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 32.4 Cg_endo -65.79 -26.72 52.37 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.031 2.488 . . . . 0.0 113.424 -175.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.23 -11.92 58.71 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.142 0.496 . . . . 0.0 111.312 -176.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.583 ' OE1' ' HB2' ' A' ' 37' ' ' SER . 1.9 mp0 -108.17 -51.03 2.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.229 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.475 ' O ' ' HB3' ' A' ' 47' ' ' LEU . 1.2 t -69.63 -20.56 63.6 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.296 -176.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.568 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.1 m-80 -105.47 3.46 29.55 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 -178.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -71.76 -46.92 56.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.741 0.305 . . . . 0.0 111.386 -176.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 1.034 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 61.1 t0 -75.68 133.6 40.77 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 178.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -23.61 66.94 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.633 178.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.3 tp -87.14 -32.6 19.79 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.288 177.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 1.034 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -64.52 -34.22 77.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.145 -177.185 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.605 ' HA ' HD22 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -64.85 -18.12 64.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.074 179.734 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -102.73 -30.44 5.52 Favored Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 111.374 -0.69 . . . . 0.0 111.374 173.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.664 ' HG ' ' HB3' ' A' ' 76' ' ' LEU . 1.9 mp -60.28 -36.45 77.85 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 122.667 0.387 . . . . 0.0 110.992 178.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.605 HD22 ' HA ' ' A' ' 48' ' ' SER . 3.8 pp -73.4 -11.25 60.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.005 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.592 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -111.99 66.31 0.24 Allowed Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.227 -178.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.87 66.7 4.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.907 0.384 . . . . 0.0 111.4 -178.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 90.43 82.92 1.38 Allowed Glycine 0 C--O 1.226 -0.356 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.04 176.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.5 tp 63.27 20.57 12.35 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.857 0.463 . . . . 0.0 112.029 176.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.791 HD11 ' HZ1' ' A' ' 69' ' ' LYS . 0.2 OUTLIER -53.87 145.84 15.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.816 178.089 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.511 ' N ' HD13 ' A' ' 56' ' ' LEU . 17.4 t-20 -113.24 -178.23 3.33 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.452 177.18 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -109.03 -158.28 18.61 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.073 -176.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.567 ' CD2' ' HB3' ' A' ' 62' ' ' ASN . 1.2 tp -77.5 138.42 39.2 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 120.737 0.303 . . . . 0.0 110.216 178.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.578 ' HG ' HG12 ' A' ' 106' ' ' VAL . 50.6 m -53.34 108.05 0.3 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.444 -175.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.11 -12.87 64.9 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.549 173.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.567 ' HB3' ' CD2' ' A' ' 59' ' ' LEU . 18.8 t30 -127.92 114.57 17.34 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.321 0.581 . . . . 0.0 110.954 -178.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.11 160.08 30.11 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.919 -178.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.418 ' C ' ' HB3' ' A' ' 38' ' ' PRO . . . 94.92 -42.45 2.39 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.617 178.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.427 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 0.7 OUTLIER -81.98 117.62 22.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.874 0.369 . . . . 0.0 110.48 -178.761 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.16 143.86 34.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.08 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.68 128.69 55.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.028 0.442 . . . . 0.0 110.858 -178.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.881 ' HB1' HD12 ' A' ' 81' ' ' LEU . . . -112.78 129.83 56.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.95 -177.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.791 ' HZ1' HD11 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -95.94 173.27 7.53 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.539 -178.943 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.24 -29.94 66.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.911 0.386 . . . . 0.0 111.207 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -28.3 68.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.096 178.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.637 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 2.0 mp -86.37 -17.71 33.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.061 0.458 . . . . 0.0 110.586 -179.031 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -63.59 -41.53 92.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.969 177.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -89.52 -12.83 38.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.271 0.558 . . . . 0.0 110.564 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.637 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.5 OUTLIER -77.04 -53.53 7.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.222 -178.344 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.664 ' HB3' ' HG ' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -125.5 -29.99 3.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.312 -175.824 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.31 48.69 18.1 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 120.302 -0.951 . . . . 0.0 111.999 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.524 HD13 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -74.95 97.29 3.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.833 0.349 . . . . 0.0 111.129 -177.716 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.34 8.46 2.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.366 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.28 -27.28 47.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.019 0.438 . . . . 0.0 109.935 174.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.881 HD12 ' HB1' ' A' ' 68' ' ' ALA . 7.9 mt -117.83 -5.62 11.06 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.597 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 11.6 t -117.46 138.0 49.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.481 178.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -132.49 178.06 7.12 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.079 178.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -136.03 98.89 3.99 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.842 0.353 . . . . 0.0 111.205 -174.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.5 t -82.3 -173.6 4.65 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.866 175.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -78.72 55.36 1.67 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.076 0.465 . . . . 0.0 110.808 -178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -161.11 -59.88 0.05 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.854 -178.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -171.82 -174.48 39.39 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.811 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.09 121.3 7.92 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.755 2.303 . . . . 0.0 110.76 174.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.564 HG13 ' HB2' ' A' ' 18' ' ' PHE . 2.7 m -136.28 -174.31 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.211 0.529 . . . . 0.0 111.619 -170.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.49 130.62 43.62 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.902 177.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.1 tttt -71.91 -43.91 64.56 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.012 0.434 . . . . 0.0 110.311 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -149.56 -100.92 0.07 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.257 -173.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 6.7 mt -73.61 126.88 35.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.765 -169.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -89.57 133.14 32.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.242 177.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.478 ' HB3' ' O ' ' A' ' 106' ' ' VAL . . . -153.5 167.53 29.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.139 0.495 . . . . 0.0 111.83 -175.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.462 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -109.26 132.75 53.82 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 174.741 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.57 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 44.0 t -152.45 135.0 8.99 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-O 120.81 0.338 . . . . 0.0 111.636 -171.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.409 ' O ' ' HD2' ' A' ' 69' ' ' LYS . 75.2 Cg_endo -77.29 -177.84 4.14 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 123.411 2.741 . . . . 0.0 111.019 172.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -76.28 -121.59 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -176.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.764 ' HA2' HD22 ' A' ' 56' ' ' LEU . . . -92.52 51.7 2.69 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 121.074 -0.584 . . . . 0.0 112.983 -176.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.35 137.23 1.08 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 176.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.2 m 72.85 147.69 0.09 Allowed 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.24 0.962 . . . . 0.0 111.653 178.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -73.09 164.11 27.17 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.857 -177.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.525 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.8 OUTLIER -111.12 143.17 42.27 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.696 -179.966 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.578 HG12 ' HG ' ' A' ' 60' ' ' SER . 0.9 OUTLIER -100.69 138.7 24.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.057 0.456 . . . . 0.0 110.435 -177.693 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.431 ' HA ' ' HB3' ' A' ' 96' ' ' ALA . . . -97.98 122.93 41.7 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.935 178.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.578 HG23 HG21 ' A' ' 25' ' ' THR . 0.1 OUTLIER -98.23 14.2 4.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.265 0.555 . . . . 0.0 111.051 -177.288 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 35.8 t0 . . . . . 0 C--N 1.321 -0.641 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.893 174.361 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.579 HD21 HD11 ' A' ' 73' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.469 0.475 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.84 -33.74 76.35 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.091 0.472 . . . . 0.0 111.016 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -4.7 57.45 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.659 -179.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.503 ' HA ' ' HA3' ' A' ' 88' ' ' GLY . 4.1 m -83.26 92.22 7.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.185 -178.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.1 -31.46 67.81 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.33 0.586 . . . . 0.0 109.652 176.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.96 -31.81 72.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.185 176.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.576 ' HD1' ' HA ' ' A' ' 90' ' ' VAL . 22.8 t80 -73.23 -35.0 66.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.246 0.546 . . . . 0.0 109.836 176.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.63 -29.57 68.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.173 0.511 . . . . 0.0 110.463 174.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.1 tttt -66.74 -38.41 86.59 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 174.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.431 ' HG2' HG12 ' A' ' 95' ' ' VAL . 0.8 OUTLIER -61.55 -35.08 76.75 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.849 176.468 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.58 -11.59 60.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.53 -178.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.14 -35.04 6.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.137 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.15 -34.37 89.49 Favored Glycine 0 N--CA 1.451 -0.366 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 175.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.22 129.9 55.76 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 174.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.9 m -68.83 98.23 0.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -170.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.425 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 98.7 m -144.65 -178.16 5.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.031 -0.986 . . . . 0.0 108.595 174.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -101.17 150.41 22.97 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.191 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.5 -31.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.783 -177.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.5 -49.41 5.82 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.545 -0.836 . . . . 0.0 111.023 175.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.47 ' HB3' ' HA ' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -87.56 53.69 2.88 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.345 -0.428 . . . . 0.0 110.738 179.034 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.454 HG21 ' O ' ' A' ' 32' ' ' ILE . 9.0 tp -108.68 139.52 30.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.936 0.398 . . . . 0.0 110.694 -179.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.73 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . . . -150.21 -178.74 6.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.348 0.594 . . . . 0.0 112.003 -177.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.467 ' HB3' HD12 ' A' ' 81' ' ' LEU . 48.8 t -133.16 134.41 44.1 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 171.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.482 ' SG ' ' HB1' ' A' ' 96' ' ' ALA . 99.3 m -106.53 145.08 32.3 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.018 0.437 . . . . 0.0 110.232 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -139.21 150.87 46.04 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.595 ' HB2' ' OE1' ' A' ' 40' ' ' GLU . 0.3 OUTLIER -42.71 139.08 2.11 Favored Pre-proline 0 CA--C 1.536 0.418 0 O-C-N 123.877 0.736 . . . . 0.0 112.434 179.807 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.448 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 20.3 Cg_endo -59.86 -40.61 61.43 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.561 2.841 . . . . 0.0 114.038 -171.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.76 -19.96 65.17 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.22 0.533 . . . . 0.0 111.661 -174.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.595 ' OE1' ' HB2' ' A' ' 37' ' ' SER . 45.3 mp0 -100.37 -39.83 7.79 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.064 -179.09 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 47.4 m -64.93 -35.49 81.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.641 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.448 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -104.04 15.7 27.94 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.862 -177.748 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -59.69 -25.59 64.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.986 -174.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 1.049 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 15.2 t70 -121.61 135.28 55.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.476 -177.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.77 -35.08 72.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.671 0.272 . . . . 0.0 111.315 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.415 ' HB3' ' OD2' ' A' ' 44' ' ' ASP . 2.6 tp -76.47 -40.52 50.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.99 0.424 . . . . 0.0 110.046 178.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 1.049 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 2.7 tp -56.74 -42.94 80.15 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.935 176.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.542 ' HA ' HD11 ' A' ' 51' ' ' LEU . 15.9 m -64.75 -9.14 18.07 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.176 -0.466 . . . . 0.0 112.213 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -108.95 -5.08 31.18 Favored Glycine 0 C--O 1.228 -0.235 0 N-CA-C 111.214 -0.754 . . . . 0.0 111.214 174.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.701 ' HG ' HD23 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -84.68 -25.81 28.19 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.546 -0.327 . . . . 0.0 111.287 -176.698 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.545 ' HG ' ' HB1' ' A' ' 66' ' ' ALA . 0.0 OUTLIER -77.4 1.23 19.64 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.448 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -146.52 85.81 0.17 Allowed Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.259 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.412 ' HB3' HD12 ' A' ' 72' ' ' LEU . . . -76.56 51.71 0.75 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.266 0.555 . . . . 0.0 110.872 178.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 171.11 -99.9 0.15 Allowed Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -149.21 48.03 0.98 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.63 0.729 . . . . 0.0 109.621 176.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.475 HD23 ' O ' ' A' ' 99' ' ' PRO . 0.2 OUTLIER -87.92 -178.89 6.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.139 -176.842 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -140.94 -176.37 4.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.033 -175.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.537 ' HA3' ' HA ' ' A' ' 66' ' ' ALA . . . -113.55 -118.66 3.46 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.289 -175.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.45 140.22 58.59 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.62 0.247 . . . . 0.0 110.338 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.57 ' HA ' ' CB ' ' A' ' 104' ' ' ASN . 64.2 m -62.85 89.89 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.368 -178.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.67 -36.42 4.26 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.947 -0.644 . . . . 0.0 112.738 177.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -91.08 101.98 14.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.026 0.441 . . . . 0.0 111.214 -176.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.72 93.54 3.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.993 179.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 170.58 -54.28 0.19 Allowed Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.279 -0.729 . . . . 0.0 111.279 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.49 106.72 8.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 174.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.545 ' HB1' ' HG ' ' A' ' 51' ' ' LEU . . . -107.09 154.87 20.52 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.561 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 4.9 m -135.46 145.69 47.43 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -177.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.473 ' HB3' HD12 ' A' ' 78' ' ' LEU . . . -105.23 130.45 53.37 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.126 0.488 . . . . 0.0 110.454 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 1.003 ' HD3' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -84.3 161.78 20.32 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.585 -178.757 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.78 -36.3 69.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.743 0.306 . . . . 0.0 111.638 -178.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.416 ' HG ' ' HG3' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -64.86 -31.05 72.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.486 0.66 . . . . 0.0 110.123 178.38 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.44 HD11 ' HA ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -79.67 -33.51 41.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.564 179.255 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.579 HD11 HD21 ' A' ' 12' ' ' LEU . 41.0 mt -66.49 -34.49 70.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.558 177.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -73.5 -40.2 64.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.688 175.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.54 -55.09 5.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -174.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.701 HD23 ' HG ' ' A' ' 50' ' ' LEU . 3.7 mp -109.85 -28.33 8.83 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.915 -0.314 . . . . 0.0 111.133 -173.169 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.61 50.43 4.72 Favored Glycine 0 CA--C 1.516 0.15 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.526 173.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.64 ' HG ' HD22 ' A' ' 50' ' ' LEU . 4.7 mp -68.04 108.3 3.03 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.108 0.48 . . . . 0.0 111.546 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.471 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -90.69 12.06 20.24 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.887 178.995 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.04 -26.46 60.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.51 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.472 HD13 ' CB ' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -119.42 9.75 11.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.52 -175.627 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.4 t -104.62 136.56 37.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.747 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 28.3 t0 -117.13 168.99 9.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.072 0.463 . . . . 0.0 111.746 -176.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -56.96 147.47 23.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.405 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.437 HG23 ' C ' ' A' ' 88' ' ' GLY . 9.5 t -153.96 155.72 36.13 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.118 0.485 . . . . 0.0 111.752 -175.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.13 -0.55 15.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.554 0.692 . . . . 0.0 109.44 174.146 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.516 ' HB3' ' H ' ' A' ' 88' ' ' GLY . 7.6 tm-20 -115.0 -86.33 0.6 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.389 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.516 ' H ' ' HB3' ' A' ' 87' ' ' GLU . . . -141.89 155.04 25.23 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 172.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -45.32 119.53 2.63 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.185 2.59 . . . . 0.0 112.094 -179.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.576 ' HA ' ' HD1' ' A' ' 18' ' ' PHE . 1.6 m -120.04 179.85 1.95 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.722 -172.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 5.2 t -67.36 130.69 43.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.626 178.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.747 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttp -77.81 -30.43 51.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.578 -177.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -149.09 -89.07 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -171.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 4.9 mt -95.97 122.43 47.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.51 -169.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.532 ' H ' HG21 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -83.36 128.88 38.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.706 179.329 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.482 ' HB1' ' SG ' ' A' ' 35' ' ' CYS . . . -154.5 170.36 21.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.601 -178.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.425 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -115.31 124.0 50.17 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.978 0.418 . . . . 0.0 110.97 179.825 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 1.003 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 3.2 m -114.65 119.56 39.37 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.936 -178.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.475 ' O ' HD23 ' A' ' 56' ' ' LEU . 68.6 Cg_endo -75.5 139.74 23.36 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.327 2.018 . . . . 0.0 111.672 174.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.416 ' HG3' ' HG ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -77.29 140.86 40.14 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 174.711 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 118.15 -91.99 0.53 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.634 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.17 179.32 6.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.674 0.273 . . . . 0.0 111.134 -175.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.67 -167.59 0.21 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.383 -0.826 . . . . 0.0 113.045 174.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.57 ' CB ' ' HA ' ' A' ' 60' ' ' SER . 80.4 m-20 -98.03 173.3 7.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.656 0.741 . . . . 0.0 112.67 -162.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 29.2 m -112.28 141.71 45.66 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.1 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -95.58 143.57 11.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 120.821 0.343 . . . . 0.0 110.344 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -105.34 115.29 30.01 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 8.9 p -91.24 0.53 8.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.753 0.787 . . . . 0.0 111.37 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.9 t0 . . . . . 0 C--N 1.314 -0.956 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.857 175.14 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.699 ' HG ' ' OG ' ' A' ' 15' ' ' SER . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.233 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 72.35 -31.0 0.22 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.771 0.829 . . . . 0.0 111.634 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.485 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -149.12 -68.56 0.21 Allowed 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.753 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.699 ' OG ' ' HG ' ' A' ' 12' ' ' LEU . 2.3 m 67.3 -67.95 0.16 Allowed 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.427 0.691 . . . . 0.0 112.555 176.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.655 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . 56.8 -87.39 0.02 OUTLIER 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.421 0.688 . . . . 0.0 111.21 -175.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.507 ' HB1' ' HG2' ' A' ' 87' ' ' GLU . . . -71.24 -35.77 71.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.876 0.37 . . . . 0.0 110.614 -179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.572 ' HB2' HG11 ' A' ' 90' ' ' VAL . 19.9 t80 -70.52 -16.71 62.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.618 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.75 -15.45 59.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.963 0.411 . . . . 0.0 110.549 177.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 3.4 mttt -83.26 -24.35 32.31 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 175.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -32.45 72.91 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.241 176.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.27 -17.14 64.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.879 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -101.09 -50.54 3.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.602 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.83 -17.78 69.75 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.704 -178.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.5 m -119.67 134.94 55.02 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.36 97.49 9.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.964 0.412 . . . . 0.0 110.98 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -140.32 -178.19 5.37 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.419 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -120.91 172.2 8.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.568 0.223 . . . . 0.0 110.94 -175.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.642 HG12 ' N ' ' A' ' 30' ' ' GLY . 14.5 p -61.77 -45.58 98.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.76 -175.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.642 ' N ' HG12 ' A' ' 29' ' ' VAL . . . -100.62 20.01 50.04 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.761 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 1.2 m -125.98 -5.58 6.79 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.552 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -80.09 126.45 39.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.591 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -148.25 160.31 43.08 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.291 0.567 . . . . 0.0 111.966 -170.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 m -114.58 139.23 49.77 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.428 174.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.62 160.16 29.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.838 0.351 . . . . 0.0 110.853 -176.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -145.74 160.03 42.31 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.758 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -51.4 150.69 6.12 Favored Pre-proline 0 CA--C 1.536 0.44 0 O-C-N 123.549 0.531 . . . . 0.0 111.321 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.484 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 47.2 Cg_exo -53.47 -49.02 18.82 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.082 2.521 . . . . 0.0 113.3 -171.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.06 -11.41 60.94 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -174.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.407 ' O ' ' HB2' ' A' ' 43' ' ' ASN . 0.1 OUTLIER -103.27 -43.85 5.33 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.085 0.469 . . . . 0.0 110.035 179.881 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.811 HG21 ' H ' ' A' ' 66' ' ' ALA . 0.6 OUTLIER -65.84 -34.28 77.8 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.147 176.104 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.686 HD21 HG23 ' A' ' 41' ' ' THR . 1.2 m-80 -104.16 14.69 29.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.312 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 4.5 t-20 -47.58 -38.7 14.95 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.537 -176.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.636 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 9.8 t70 -113.2 142.18 46.09 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.0 -35.21 74.54 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.231 0.332 . . . . 0.0 111.149 -179.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.37 -32.33 58.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.921 0.391 . . . . 0.0 109.954 178.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.636 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.6 OUTLIER -61.72 -39.36 91.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.522 -179.128 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.617 ' HA ' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -58.22 -31.38 67.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.478 179.505 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -84.13 -30.31 28.68 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.911 178.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.4 mp -69.28 -20.93 63.91 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.815 0.34 . . . . 0.0 111.096 -178.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 48' ' ' SER . 3.3 mt -74.01 -14.1 60.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.532 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.634 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -126.97 76.42 0.4 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.599 -0.81 . . . . 0.0 111.621 -177.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.91 -20.35 33.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.969 0.414 . . . . 0.0 110.798 -176.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -139.01 68.23 0.5 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.509 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 mt 53.03 45.89 27.86 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.389 0.614 . . . . 0.0 111.112 177.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.634 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -84.73 161.19 20.11 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.351 -177.305 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.577 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 30.8 t-20 -126.08 -177.68 4.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.875 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -100.03 -152.77 26.9 Favored Glycine 0 C--O 1.225 -0.444 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.009 -176.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.791 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -70.35 146.37 50.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.979 0.419 . . . . 0.0 110.864 179.938 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.4 m -59.23 98.04 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.516 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.39 4.89 65.79 Favored Glycine 0 C--O 1.229 -0.203 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.424 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.791 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 18.8 t30 -128.93 100.56 5.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.181 0.515 . . . . 0.0 110.796 -177.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.19 71.85 9.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.282 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -166.21 -61.71 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.981 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.71 113.44 18.9 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.023 0.439 . . . . 0.0 110.973 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.811 ' H ' HG21 ' A' ' 41' ' ' THR . . . -107.53 153.71 22.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.216 173.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.61 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 0.1 OUTLIER -126.53 141.04 52.0 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.538 -175.5 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.879 ' HB3' HD12 ' A' ' 81' ' ' LEU . . . -105.41 128.6 53.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.333 0.587 . . . . 0.0 110.043 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.636 ' HG2' ' HB2' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -76.83 170.17 16.96 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.724 -176.808 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.55 -27.74 67.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.879 0.371 . . . . 0.0 111.308 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.55 -31.11 63.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.945 0.879 . . . . 0.0 109.071 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.636 ' HB2' ' HG2' ' A' ' 69' ' ' LYS . 0.5 OUTLIER -80.96 -27.07 36.16 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.277 178.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 69' ' ' LYS . 23.8 mm -64.6 -42.77 96.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.724 176.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -20.57 63.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.385 177.065 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.521 ' HB3' HD12 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -70.38 -53.83 14.96 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.504 -177.075 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.521 HD12 ' HB3' ' A' ' 75' ' ' GLN . 0.7 OUTLIER -136.95 -5.92 1.89 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -171.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.44 51.92 7.01 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 119.799 -1.191 . . . . 0.0 112.12 -178.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.36 83.68 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.968 0.413 . . . . 0.0 111.781 -176.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.507 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -71.91 4.85 3.01 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -175.191 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.63 -23.13 42.82 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -175.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.879 HD12 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -125.57 -4.47 7.16 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.22 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.501 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -115.94 138.22 47.09 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.525 0 CA-C-O 121.513 0.673 . . . . 0.0 111.789 -177.382 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.866 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 21.7 t70 -112.96 153.44 28.02 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.962 -1.017 . . . . 0.0 108.578 176.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -117.65 103.33 9.93 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.998 -174.24 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 78.3 p -104.75 -168.69 1.51 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.396 175.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.03 -25.32 67.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.771 0.32 . . . . 0.0 111.043 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.655 ' HB3' ' HB3' ' A' ' 16' ' ' ALA . 2.5 mp0 -71.54 -32.01 67.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.286 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 130.2 -146.1 17.2 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.481 -0.866 . . . . 0.0 111.794 -178.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -74.76 108.7 2.76 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.958 2.439 . . . . 0.0 111.346 175.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.572 HG11 ' HB2' ' A' ' 18' ' ' PHE . 0.6 OUTLIER -122.41 162.51 22.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.05 -179.231 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -67.27 124.17 22.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.941 0.401 . . . . 0.0 110.52 -177.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.866 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 2.4 tttp -70.83 -24.0 62.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.827 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.41 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -152.8 -95.18 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.14 -174.343 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.485 HG22 ' HB3' ' A' ' 109' ' ' ASP . 0.5 OUTLIER -92.81 136.77 23.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.597 -173.024 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.446 ' H ' HG13 ' A' ' 95' ' ' VAL . 0.6 OUTLIER -97.61 129.23 48.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 172.829 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -140.8 163.8 31.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.921 0.391 . . . . 0.0 111.363 -174.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.84 109.08 19.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.159 177.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.761 ' O ' ' HA ' ' A' ' 31' ' ' SER . 64.1 m -110.87 116.79 51.51 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.505 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.0 132.9 14.56 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.273 1.982 . . . . 0.0 111.934 177.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.12 120.18 23.28 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.086 176.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.484 ' O ' ' HB ' ' A' ' 102' ' ' THR . . . 137.87 -52.01 0.76 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.077 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.484 ' HB ' ' O ' ' A' ' 101' ' ' GLY . 5.1 t 176.33 177.52 0.24 Allowed 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.506 -0.183 . . . . 0.0 110.506 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.568 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.6 OUTLIER 76.34 157.75 0.19 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.023 0.929 . . . . 0.0 112.517 179.092 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.577 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.3 OUTLIER -75.08 175.52 8.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.818 -175.023 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 10.9 m -112.11 141.9 45.22 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.884 -178.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.42 ' O ' HG23 ' A' ' 106' ' ' VAL . 2.7 m -91.88 138.94 18.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.616 174.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.7 128.93 44.73 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.434 ' H ' HG22 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -94.61 7.03 6.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.591 0.71 . . . . 0.0 110.781 -178.042 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . 0.485 ' HB3' HG22 ' A' ' 94' ' ' ILE . 2.6 t70 . . . . . 0 C--N 1.315 -0.933 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.38 172.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.461 HD13 ' CD1' ' A' ' 18' ' ' PHE . 1.0 OUTLIER . . . . . 0 CA--C 1.53 0.209 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.98 -41.37 64.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.161 0.505 . . . . 0.0 110.5 -178.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.21 6.39 8.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.901 -178.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.514 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 15.2 m -72.92 -25.78 61.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.14 174.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.94 -53.51 0.51 Allowed 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.906 0.754 . . . . 0.0 111.354 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.538 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . . . -63.1 -33.01 74.54 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.858 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.606 ' HE2' ' SG ' ' A' ' 34' ' ' CYS . 15.9 t80 -72.14 -28.46 63.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.151 177.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.33 -22.32 63.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.748 177.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.538 ' HE2' ' HA ' ' A' ' 17' ' ' ALA . 55.4 mttm -67.63 -29.58 68.94 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.82 -31.91 73.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.639 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.13 -18.63 63.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.526 -177.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -108.66 -25.1 11.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.783 179.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -77.13 -26.43 61.97 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.319 179.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.474 HG21 HG21 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -137.99 155.44 48.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.666 0.269 . . . . 0.0 110.433 -179.649 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.16 95.73 9.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.198 0.523 . . . . 0.0 110.414 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -148.44 132.25 17.01 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.642 175.908 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -80.38 173.71 12.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.318 -177.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.8 p -55.78 -41.76 67.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 120.751 0.31 . . . . 0.0 111.356 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -95.36 12.36 68.02 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.295 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 99' ' ' PRO . 0.7 OUTLIER -130.68 16.35 5.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.949 0.404 . . . . 0.0 110.637 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -106.49 133.14 51.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 175.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.595 ' HB3' ' HA ' ' A' ' 69' ' ' LYS . . . -150.45 178.97 8.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.503 0.668 . . . . 0.0 112.319 -171.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.606 ' SG ' ' HE2' ' A' ' 18' ' ' PHE . 3.8 m -127.45 135.07 49.9 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.792 -1.095 . . . . 0.0 108.806 171.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.515 ' HB3' ' HB ' ' A' ' 94' ' ' ILE . 0.4 OUTLIER -110.92 158.41 18.77 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.111 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.627 ' OD1' ' HB3' ' A' ' 40' ' ' GLU . 11.0 t-20 -148.96 159.24 44.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.679 0.276 . . . . 0.0 110.843 -172.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.417 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -50.61 132.71 27.13 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.528 177.489 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 37' ' ' SER . 63.8 Cg_exo -53.38 -43.3 58.63 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.31 2.673 . . . . 0.0 113.42 -177.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.09 -8.12 52.82 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.969 0.414 . . . . 0.0 111.029 -177.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.627 ' HB3' ' OD1' ' A' ' 36' ' ' ASN . 1.5 tt0 -103.47 -46.81 4.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.563 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 43.8 m -60.18 -38.12 82.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.978 176.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -102.41 14.74 31.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.006 -177.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -62.4 -42.02 99.11 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.144 -177.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 1.033 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 21.7 t70 -87.57 140.88 29.07 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.531 178.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.26 -40.24 89.62 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.825 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.62 -19.73 22.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.046 -175.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 1.033 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -57.24 -35.64 69.96 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.209 -179.729 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.42 -23.32 67.35 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.87 0.366 . . . . 0.0 111.386 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -100.7 -19.07 18.83 Favored Glycine 0 C--N 1.33 0.229 0 N-CA-C 111.283 -0.727 . . . . 0.0 111.283 174.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.577 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 2.3 tp -64.34 -35.06 79.65 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 122.596 0.359 . . . . 0.0 110.904 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.479 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -72.43 -34.55 67.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.172 0.511 . . . . 0.0 110.637 178.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.21 53.37 4.76 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.568 -175.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.405 ' HB2' HD13 ' A' ' 72' ' ' LEU . . . -73.79 -27.48 61.16 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.4 0.619 . . . . 0.0 110.527 178.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -137.9 -94.28 0.33 Allowed Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.519 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.566 ' HB3' ' HA2' ' A' ' 101' ' ' GLY . 0.5 OUTLIER -130.23 58.82 1.65 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.94 0.4 . . . . 0.0 110.027 178.448 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.529 HD13 ' HA ' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -80.81 103.1 10.43 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.59 0.71 . . . . 0.0 110.146 177.885 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.665 HD21 ' HA ' ' A' ' 104' ' ' ASN . 2.2 p-10 -89.99 171.4 9.6 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 114.47 -1.241 . . . . 0.0 109.375 175.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.31 -160.12 34.3 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.581 -0.819 . . . . 0.0 113.168 -174.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.576 HD22 ' HB2' ' A' ' 107' ' ' ALA . 0.8 OUTLIER -67.98 159.33 30.88 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 122.545 0.338 . . . . 0.0 111.671 -178.303 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.571 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 0.4 OUTLIER -55.04 87.23 0.01 OUTLIER 'General case' 0 C--O 1.233 0.187 0 C-N-CA 123.841 0.856 . . . . 0.0 111.918 178.909 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.77 8.05 84.99 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.514 178.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -120.5 102.38 8.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.976 0.417 . . . . 0.0 111.509 -178.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.37 104.17 5.82 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.51 176.029 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 157.37 -61.38 0.33 Allowed Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.178 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.85 119.88 21.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.902 0.382 . . . . 0.0 110.073 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -114.27 135.83 53.64 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.197 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.07 132.36 56.68 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.529 ' HA ' HD13 ' A' ' 56' ' ' LEU . . . -103.78 129.32 51.18 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.055 0.455 . . . . 0.0 110.305 -177.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.595 ' HA ' ' HB3' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -75.63 168.03 20.79 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.323 -177.023 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.87 -31.88 67.13 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.678 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.6 -35.44 73.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.261 0.553 . . . . 0.0 109.541 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.533 HD11 HD11 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -76.89 -32.49 57.47 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.294 178.849 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.1 mt -60.81 -38.3 78.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.579 176.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.54 -24.47 49.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.033 177.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.04 -53.67 7.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.26 -0.427 . . . . 0.0 112.077 -175.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.577 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.9 OUTLIER -117.41 -24.43 7.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -172.9 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.89 50.59 6.85 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 119.974 -1.108 . . . . 0.0 112.367 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.801 HD21 HD22 ' A' ' 47' ' ' LEU . 2.4 mp -74.86 92.85 2.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.946 0.403 . . . . 0.0 110.735 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.409 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -77.46 6.51 6.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.713 -177.825 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.87 -44.86 79.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.236 0.541 . . . . 0.0 110.379 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.625 ' HA ' ' HB2' ' A' ' 36' ' ' ASN . 0.0 OUTLIER -94.74 2.83 55.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.231 -176.808 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 16.3 t -115.22 138.29 46.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.234 0.54 . . . . 0.0 110.826 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.646 ' HB2' ' HD3' ' A' ' 92' ' ' LYS . 31.7 t0 -128.97 164.69 22.62 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 175.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -110.23 135.81 50.41 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.081 0.467 . . . . 0.0 111.513 -176.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.61 HG23 HG22 ' A' ' 90' ' ' VAL . 2.1 p -120.92 -169.51 1.84 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.343 176.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -66.93 -32.49 73.78 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.745 0.653 . . . . 0.0 109.941 174.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.514 ' HB3' ' O ' ' A' ' 15' ' ' SER . 0.5 OUTLIER -72.93 -54.81 7.72 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.873 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 166.43 -152.13 20.93 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.253 -0.975 . . . . 0.0 112.403 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -70.09 120.75 7.43 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 123.001 2.467 . . . . 0.0 111.022 174.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.61 HG22 HG23 ' A' ' 85' ' ' THR . 0.9 OUTLIER -135.4 -175.16 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.948 0.404 . . . . 0.0 111.064 -174.855 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.51 125.27 26.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.791 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.646 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 14.3 tptm -68.89 -41.46 78.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.82 -177.194 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -146.68 -63.36 0.3 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.575 -172.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.515 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 2.2 mt -109.19 122.15 63.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.99 0.424 . . . . 0.0 111.718 -173.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.516 ' H ' HG13 ' A' ' 95' ' ' VAL . 0.2 OUTLIER -85.46 126.92 40.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.806 175.527 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.419 ' HB1' ' HA ' ' A' ' 107' ' ' ALA . . . -154.29 152.58 30.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.303 -176.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 6.9 m -104.17 107.87 18.97 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 176.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.527 ' HA ' ' HB3' ' A' ' 105' ' ' CYS . 53.9 t -119.66 117.25 32.79 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.571 -173.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.56 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 3.1 Cg_exo -80.01 154.8 22.76 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.047 2.498 . . . . 0.0 111.944 175.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.446 ' HG2' ' HG3' ' A' ' 69' ' ' LYS . 0.9 OUTLIER -88.27 100.89 13.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 171.885 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.566 ' HA2' ' HB3' ' A' ' 55' ' ' LEU . . . 110.73 68.42 0.57 Allowed Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.217 -0.992 . . . . 0.0 112.53 -178.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.444 HG23 ' HG2' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -146.28 -177.8 5.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.746 0.308 . . . . 0.0 111.081 -178.406 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 14.1 m -82.23 -47.88 11.92 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 172.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.665 ' HA ' HD21 ' A' ' 57' ' ' ASN . 18.0 p30 -154.63 163.69 39.86 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.138 174.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.527 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 34.7 m -112.34 141.99 45.4 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -97.25 132.21 42.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.184 0.516 . . . . 0.0 111.499 -172.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.576 ' HB2' HD22 ' A' ' 59' ' ' LEU . . . -88.45 130.97 35.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.503 173.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.474 HG21 HG21 ' A' ' 25' ' ' THR . 0.0 OUTLIER -108.98 25.13 2.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.938 -172.424 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 . . . . . 0 C--N 1.324 -0.531 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.501 179.498 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.748 HD11 ' HB1' ' A' ' 70' ' ' ALA . 6.3 mp . . . . . 0 CA--C 1.527 0.096 0 CA-C-O 120.523 0.201 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 69.26 -32.28 0.22 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.968 0.907 . . . . 0.0 111.774 -178.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.531 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -156.51 -57.42 0.09 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 47.6 46.78 17.86 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.189 -178.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.09 -62.02 2.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.943 0.401 . . . . 0.0 111.441 -173.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.11 -25.47 55.45 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.958 0.408 . . . . 0.0 110.76 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -64.66 -38.26 90.41 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.419 178.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.92 -19.92 64.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.492 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.88 -30.08 63.68 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -72.6 -26.16 61.59 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.289 176.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.0 -5.55 44.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.79 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -81.01 -21.36 40.27 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.151 0.501 . . . . 0.0 110.18 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.78 -27.71 49.51 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.703 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.39 113.17 7.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.865 0.364 . . . . 0.0 110.942 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.9 m -68.66 113.38 6.1 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.925 175.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.452 ' HB3' HG13 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -148.6 161.77 41.03 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.698 178.414 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.414 ' H ' ' HB2' ' A' ' 31' ' ' SER . 17.0 t-20 -87.44 171.49 10.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.777 -176.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.8 m -63.86 -36.81 77.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.831 0.348 . . . . 0.0 110.599 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -92.39 25.29 18.7 Favored Glycine 0 N--CA 1.451 -0.326 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 175.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.486 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 1.4 m -142.79 -9.19 0.81 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.069 0.462 . . . . 0.0 110.523 177.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.452 HG13 ' HB3' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -94.81 133.79 34.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 177.596 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.59 165.54 30.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.459 0.647 . . . . 0.0 112.625 -171.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.4 t -124.5 144.51 50.06 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.798 -1.092 . . . . 0.0 109.309 173.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.556 ' HB3' HG12 ' A' ' 94' ' ' ILE . 0.1 OUTLIER -124.41 155.53 38.67 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.771 0.319 . . . . 0.0 110.402 -179.311 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -134.59 159.49 41.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.737 178.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.38 142.9 67.58 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.789 178.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.416 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 74.2 Cg_exo -51.49 -33.04 45.73 Favored 'Trans proline' 0 N--CA 1.478 0.567 0 C-N-CA 123.797 2.998 . . . . 0.0 113.847 -174.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.83 -7.65 23.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.023 0.439 . . . . 0.0 111.56 -178.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -113.38 -39.98 3.98 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.202 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.19 -33.32 75.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.44 0.638 . . . . 0.0 110.61 176.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 2.2 m-80 -102.92 14.05 32.87 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.274 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -66.34 -28.95 69.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.614 -176.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.933 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 7.3 t0 -115.06 140.86 48.71 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.871 177.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -26.3 66.0 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.991 0.424 . . . . 0.0 110.745 177.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.444 ' HA ' HD12 ' A' ' 46' ' ' LEU . 1.0 OUTLIER -86.0 -24.0 26.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.175 177.756 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.933 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -62.12 -42.63 99.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.249 -177.436 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.878 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -65.38 -26.97 68.23 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.708 -175.562 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.84 -21.35 33.9 Favored Glycine 0 C--N 1.329 0.151 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.349 174.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.723 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 1.2 tp -70.72 -35.82 72.9 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.473 -0.363 . . . . 0.0 110.564 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.878 HD21 ' HA ' ' A' ' 48' ' ' SER . 1.6 pp -74.15 -26.13 60.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.241 -178.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.95 58.01 2.88 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.696 -177.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.435 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -79.55 59.61 3.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.075 0.464 . . . . 0.0 111.575 -176.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 120.22 70.14 0.31 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.615 176.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 15.0 mt 56.59 32.55 21.14 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.351 0.596 . . . . 0.0 111.363 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.88 145.0 31.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.099 -177.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.67 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 4.6 t-20 -120.68 -178.24 3.67 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -116.3 -122.7 3.44 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.521 -0.847 . . . . 0.0 112.245 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.697 HD23 ' HB2' ' A' ' 65' ' ' SER . 1.8 mm? -65.31 144.09 57.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.683 0.277 . . . . 0.0 110.726 -179.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.586 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -58.17 94.16 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.813 -179.793 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.42 -8.02 79.51 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 121.125 -0.56 . . . . 0.0 113.237 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -105.57 141.46 36.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.446 0.641 . . . . 0.0 111.583 -175.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -104.37 136.37 44.08 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.78 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 112.74 -39.29 2.91 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.886 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.697 ' HB2' HD23 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -97.46 116.22 29.25 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.592 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.32 150.81 49.91 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.491 -178.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.401 ' HA ' HD21 ' A' ' 81' ' ' LEU . 0.1 OUTLIER -129.97 146.72 51.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.673 0.273 . . . . 0.0 110.932 -177.019 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.424 ' HB1' HD12 ' A' ' 81' ' ' LEU . . . -114.83 155.21 27.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.156 178.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.467 ' HD2' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -100.44 174.85 5.91 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.814 -173.545 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.748 ' HB1' HD11 ' A' ' 12' ' ' LEU . . . -61.3 -39.34 90.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.111 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.5 -36.42 83.79 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.979 0.418 . . . . 0.0 110.488 177.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.639 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 1.2 tp -72.88 -21.85 60.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.844 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.677 HD11 ' HA ' ' A' ' 70' ' ' ALA . 0.2 OUTLIER -60.43 -40.22 83.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.874 176.369 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -88.27 2.17 52.96 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.317 0.58 . . . . 0.0 110.736 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.639 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.4 OUTLIER -94.23 -53.66 3.86 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.062 -177.861 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.723 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.8 OUTLIER -121.02 -16.05 8.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 -174.246 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.77 49.09 45.0 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.326 -0.94 . . . . 0.0 112.075 -179.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.72 98.47 4.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.905 0.383 . . . . 0.0 111.272 -176.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 3.82 11.3 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.406 179.259 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.46 -41.11 80.67 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -177.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.424 HD12 ' HB1' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -116.83 4.0 12.94 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -174.097 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.4 t -111.18 136.71 46.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.292 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.698 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 5.5 t0 -119.33 168.19 11.17 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -129.97 99.1 4.97 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.936 0.398 . . . . 0.0 111.189 -177.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.422 ' OG1' HG21 ' A' ' 90' ' ' VAL . 41.4 p -96.88 -169.09 1.81 Allowed 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 173.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -81.87 8.22 10.88 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.313 0.578 . . . . 0.0 110.081 175.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -104.74 4.29 32.24 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.645 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 99.69 -161.24 19.55 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.139 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -65.2 116.9 4.12 Favored 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.853 2.369 . . . . 0.0 111.237 173.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.422 HG21 ' OG1' ' A' ' 85' ' ' THR . 2.5 m -134.19 177.78 6.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.04 0.448 . . . . 0.0 111.717 -172.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.7 130.89 44.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.473 177.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.698 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttm -82.38 -32.89 28.96 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.884 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -141.8 -94.55 0.13 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.768 -174.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.556 HG12 ' HB3' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -107.0 147.73 11.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.015 0.436 . . . . 0.0 111.217 -172.748 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.408 ' H ' HG11 ' A' ' 95' ' ' VAL . 3.3 p -100.66 139.55 21.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.431 -179.221 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.482 ' HB3' ' HA ' ' A' ' 107' ' ' ALA . . . -146.49 160.67 41.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.001 0.429 . . . . 0.0 111.694 -175.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 1.3 m -104.89 107.73 18.86 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 174.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.727 ' HA ' ' HB3' ' A' ' 105' ' ' CYS . 9.9 t -124.62 108.47 28.79 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.901 -169.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.534 ' HD2' ' SG ' ' A' ' 105' ' ' CYS . 56.9 Cg_endo -69.47 126.71 13.83 Favored 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 122.633 2.222 . . . . 0.0 112.568 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.17 104.43 6.69 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 164.11 -67.46 0.22 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.399 -0.905 . . . . 0.0 112.687 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -161.59 159.13 27.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.751 0.276 . . . . 0.0 111.353 -177.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.3 m 72.53 166.95 0.31 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.584 0.707 . . . . 0.0 112.699 171.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.67 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.4 OUTLIER -74.46 163.5 27.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.312 -172.036 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.727 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 9.3 m -120.34 144.59 47.78 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.941 -175.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -90.66 148.31 4.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.482 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.482 ' HA ' ' HB3' ' A' ' 96' ' ' ALA . . . -109.52 140.39 43.36 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.497 178.495 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -100.98 -0.26 10.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.512 0.672 . . . . 0.0 111.051 -178.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . 0.417 ' OD2' ' HB ' ' A' ' 94' ' ' ILE . 1.9 t70 . . . . . 0 C--N 1.317 -0.809 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.284 176.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.522 HD21 ' HA ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.53 0.2 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.14 -32.18 38.95 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.631 -177.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.73 5.11 4.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.863 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.437 ' O ' ' HB2' ' A' ' 87' ' ' GLU . 94.5 p -80.97 -34.33 33.2 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.09 -53.22 0.47 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.914 0.886 . . . . 0.0 111.27 -175.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.612 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . . . -66.82 -24.55 66.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.77 -177.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.652 ' HB2' HG11 ' A' ' 90' ' ' VAL . 36.3 t80 -87.9 -25.99 22.96 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.17 174.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.43 -40.21 93.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.272 178.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.612 ' HD3' ' HA ' ' A' ' 17' ' ' ALA . 0.0 OUTLIER -69.54 -24.51 63.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.462 0.649 . . . . 0.0 109.815 176.599 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.559 HE21 ' HA ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -74.63 -34.01 62.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.05 177.58 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.78 -18.51 64.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.758 -177.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -87.05 -1.14 57.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.984 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -73.98 -26.37 69.09 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.069 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.56 172.32 13.06 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.99 96.9 1.36 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.986 0.422 . . . . 0.0 109.936 173.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 66.7 m -130.49 134.59 47.2 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.85 -175.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -145.45 -163.08 1.64 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.463 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.5 ' O ' HG12 ' A' ' 29' ' ' VAL . 1.6 p -61.96 135.23 26.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.996 0.427 . . . . 0.0 110.121 177.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.93 -8.19 4.82 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 120.964 -0.636 . . . . 0.0 113.226 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.415 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -114.1 -6.35 13.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.952 0.405 . . . . 0.0 110.698 179.936 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.418 HG22 ' HB3' ' A' ' 70' ' ' ALA . 0.1 OUTLIER -91.68 128.79 43.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.84 177.2 10.03 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.063 0.458 . . . . 0.0 111.707 -174.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.3 m -140.54 147.47 39.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.625 173.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -128.33 160.27 32.71 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.238 0.542 . . . . 0.0 111.039 -176.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 42.6 t-20 -153.78 159.98 42.09 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.129 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -48.58 137.88 12.13 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 123.636 0.585 . . . . 0.0 111.452 177.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.577 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 10.0 Cg_endo -52.91 -35.21 69.88 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.281 2.654 . . . . 0.0 112.94 -179.398 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.44 -19.88 62.47 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.82 0.343 . . . . 0.0 111.735 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -91.92 -52.45 4.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.136 0.493 . . . . 0.0 110.018 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.546 ' O ' ' HB3' ' A' ' 47' ' ' LEU . 1.2 t -69.99 -21.05 63.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.643 -177.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.577 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -105.94 7.46 32.1 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.478 -179.043 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -66.8 -34.49 77.93 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.323 0.582 . . . . 0.0 110.704 -178.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 1.098 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 13.3 t0 -96.37 134.68 39.22 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.216 177.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.19 -24.82 68.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.815 0.341 . . . . 0.0 111.244 -179.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.2 tp -91.76 -22.08 20.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.935 0.398 . . . . 0.0 110.831 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 1.098 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -66.08 -31.68 72.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.007 -177.144 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.94 -14.52 63.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.243 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -104.82 -20.03 10.37 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.598 173.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.585 ' HB3' HD12 ' A' ' 78' ' ' LEU . 1.1 mp -73.35 -22.37 60.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.889 0.376 . . . . 0.0 111.185 -177.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.494 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -75.63 -12.55 60.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.327 -178.737 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.571 ' HA2' HD22 ' A' ' 56' ' ' LEU . . . -138.27 86.53 0.22 Allowed Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.561 -178.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.37 -21.69 66.71 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -177.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.59 67.12 0.37 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.353 -0.927 . . . . 0.0 113.044 179.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 mp 61.49 40.89 13.28 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.157 0.503 . . . . 0.0 111.74 173.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.603 HD23 ' HE3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -72.86 172.45 10.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.414 -178.371 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -117.03 -177.83 3.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.86 -176.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -116.34 -151.49 9.65 Favored Glycine 0 C--O 1.228 -0.271 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.209 -175.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.443 HD21 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -66.43 134.75 53.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.839 0.352 . . . . 0.0 110.308 177.958 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.48 105.78 1.01 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.798 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 102.15 -38.7 3.06 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.453 176.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -95.98 102.87 14.72 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.666 0.27 . . . . 0.0 110.653 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.15 71.38 2.89 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.015 0.436 . . . . 0.0 111.103 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -160.83 -58.76 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.012 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.18 139.62 44.57 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.877 0.37 . . . . 0.0 111.158 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.433 ' O ' HD22 ' A' ' 81' ' ' LEU . . . -128.31 131.68 48.65 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 176.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 m -115.71 131.69 56.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.103 0.477 . . . . 0.0 110.688 -176.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.547 ' H ' HD11 ' A' ' 81' ' ' LEU . . . -104.37 144.0 32.24 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.849 -177.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.693 ' HG3' ' HG2' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -89.82 161.26 16.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.49 -174.088 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.459 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -58.38 -25.64 62.28 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -175.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.86 -27.15 60.14 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.808 0.813 . . . . 0.0 109.005 -177.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.467 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -90.93 -17.12 26.94 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.306 -178.461 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.459 HD12 ' HA ' ' A' ' 70' ' ' ALA . 1.3 mt -66.15 -39.42 84.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.3 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.22 7.91 20.32 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.126 0.489 . . . . 0.0 110.731 177.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.478 ' HB3' HD13 ' A' ' 76' ' ' LEU . 0.8 OUTLIER -88.27 -53.41 4.71 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.763 -179.31 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.478 HD13 ' HB3' ' A' ' 75' ' ' GLN . 0.8 OUTLIER -135.2 0.83 2.88 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -173.238 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.78 52.98 4.16 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 119.718 -1.229 . . . . 0.0 113.055 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.585 HD12 ' HB3' ' A' ' 50' ' ' LEU . 4.5 mm? -67.97 66.56 0.1 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 122.663 0.385 . . . . 0.0 111.849 -178.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.34 -4.87 28.49 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -175.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.492 ' HB1' HD11 ' A' ' 47' ' ' LEU . . . -79.48 -31.23 42.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.76 0.314 . . . . 0.0 111.623 -176.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.547 HD11 ' H ' ' A' ' 68' ' ' ALA . 28.0 mt -102.81 -21.95 13.96 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.955 0.407 . . . . 0.0 111.177 -174.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -110.28 138.17 39.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.196 178.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.714 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 16.5 t0 -110.78 158.66 18.42 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.748 176.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -116.28 116.33 27.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.257 0.551 . . . . 0.0 111.575 -177.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.467 ' HG1' ' CG2' ' A' ' 90' ' ' VAL . 2.5 p -107.94 -175.47 2.79 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.397 -0.82 . . . . 0.0 108.873 174.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -66.12 -27.74 68.28 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.805 0.336 . . . . 0.0 111.448 -177.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 15' ' ' SER . 1.1 pm0 -70.65 -39.59 73.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.032 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 151.62 -159.79 28.45 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.108 -178.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -71.57 122.31 8.48 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 123.056 2.504 . . . . 0.0 111.286 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.652 HG11 ' HB2' ' A' ' 18' ' ' PHE . 1.5 m -138.51 169.83 17.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.76 -175.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.56 127.21 31.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.724 0.297 . . . . 0.0 110.481 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.714 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 2.0 tttt -67.36 -64.45 0.85 Allowed 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.082 -173.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.48 -61.8 1.37 Allowed 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.512 -172.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.9 mt -108.83 119.24 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.107 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.4 p -79.85 112.05 17.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.416 0.627 . . . . 0.0 109.831 175.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -151.02 137.69 18.83 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.068 -176.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 1.2 m -104.66 149.87 25.19 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.975 0.417 . . . . 0.0 110.482 -176.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.415 ' O ' ' HA ' ' A' ' 31' ' ' SER . 7.2 t -148.08 136.35 11.25 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.079 -167.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -81.95 152.19 16.62 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.701 2.267 . . . . 0.0 111.927 178.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.693 ' HG2' ' HG3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -89.43 157.24 18.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.864 0.364 . . . . 0.0 110.094 175.532 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 96.87 -56.31 1.32 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.068 -0.587 . . . . 0.0 111.99 -178.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.7 t -177.97 -173.77 0.4 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.7 m 74.75 148.66 0.1 Allowed 'General case' 0 C--N 1.33 -0.251 0 O-C-N 123.849 0.718 . . . . 0.0 111.195 -177.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -74.29 174.6 8.59 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.467 -175.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.411 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -109.98 146.82 34.61 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.894 177.502 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -102.05 138.44 26.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.853 0.359 . . . . 0.0 110.356 -177.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -110.48 108.32 18.28 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 4.9 p -74.88 -4.15 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.735 0.779 . . . . 0.0 111.622 -173.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.311 -1.105 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.41 179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.528 HD12 ' HB2' ' A' ' 70' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.83 -30.83 71.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.923 0.392 . . . . 0.0 111.239 -179.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.31 -17.15 56.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.407 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.15 74.43 6.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.43 179.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.65 -40.14 62.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.549 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.58 -31.0 71.04 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.893 -177.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.436 ' HB2' HG12 ' A' ' 90' ' ' VAL . 88.8 t80 -70.18 -43.95 69.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.118 0.485 . . . . 0.0 110.111 -179.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.22 -30.24 48.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.366 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -63.3 -35.46 80.43 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.664 0.745 . . . . 0.0 109.237 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -30.43 67.17 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.526 176.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.56 -8.54 56.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.649 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.89 -5.62 59.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.031 0.443 . . . . 0.0 110.273 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.24 -9.16 55.93 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.156 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.5 m -134.57 152.78 52.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.82 95.58 7.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.14 0.495 . . . . 0.0 111.655 -177.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.5 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -140.95 155.91 46.16 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 173.206 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -112.85 -179.32 3.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.533 0.206 . . . . 0.0 110.481 -174.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 29' ' ' VAL . 2.1 m -60.38 138.07 21.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 176.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 80.11 -13.84 24.12 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.321 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.685 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -104.93 -2.94 23.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.79 0.295 . . . . 0.0 111.228 179.556 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.471 ' H ' HG12 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -81.26 106.12 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 176.9 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.656 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -122.25 144.92 48.68 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.991 0.424 . . . . 0.0 111.649 -173.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 5.5 t -107.98 133.37 52.4 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.519 174.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.69 ' HB2' ' HB ' ' A' ' 94' ' ' ILE . 37.5 m -112.68 149.66 32.58 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.51 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.424 ' HB2' HD21 ' A' ' 81' ' ' LEU . 38.1 t-20 -136.56 152.8 50.89 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 174.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m -45.8 133.8 6.6 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 123.485 0.49 . . . . 0.0 110.884 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_endo -47.02 -44.92 22.25 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 124.043 3.162 . . . . 0.0 114.351 -172.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.1 -11.24 60.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.952 0.406 . . . . 0.0 111.835 -176.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.92 -38.66 6.91 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.752 HG21 HD13 ' A' ' 47' ' ' LEU . 1.4 m -60.26 -43.12 96.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.21 173.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -90.01 5.88 44.68 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.192 -176.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -81.19 -7.61 59.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.427 0.632 . . . . 0.0 109.646 175.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -96.34 144.16 26.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.349 177.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -82.32 -21.68 35.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.329 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 mp -82.06 -52.86 6.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.619 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.752 ' HA ' ' HB3' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -54.05 -36.62 63.28 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.935 179.994 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 t -58.75 -25.23 62.79 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.401 -178.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -105.72 -24.06 7.19 Favored Glycine 0 C--N 1.334 0.422 0 N-CA-C 111.534 -0.627 . . . . 0.0 111.534 173.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.83 HD13 ' HG ' ' A' ' 72' ' ' LEU . 0.4 OUTLIER -67.87 -20.06 65.09 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 122.75 0.42 . . . . 0.0 110.783 179.189 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.493 ' HG ' ' HB3' ' A' ' 66' ' ' ALA . 0.0 OUTLIER -46.08 -35.23 4.73 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.652 0.595 . . . . 0.0 111.736 177.489 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.8 79.34 0.32 Allowed Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.485 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.404 ' CB ' HD12 ' A' ' 72' ' ' LEU . . . -67.53 -28.34 67.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.556 0.693 . . . . 0.0 109.251 174.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -133.96 -107.55 0.99 Allowed Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 110.361 -1.096 . . . . 0.0 110.361 172.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.1 mt -117.68 47.13 1.6 Allowed 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 174.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 mt -78.0 176.17 9.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.877 -174.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.572 ' CB ' ' HA ' ' A' ' 104' ' ' ASN . 3.0 m120 -138.83 -177.43 4.87 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.737 -175.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -112.41 -135.86 6.59 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.671 -0.775 . . . . 0.0 112.089 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.621 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -64.88 150.23 48.11 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.855 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.436 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -55.06 89.07 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.094 0.557 . . . . 0.0 112.099 -179.78 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.92 2.29 61.14 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 121.079 -0.582 . . . . 0.0 112.443 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.621 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 32.5 t-20 -122.35 98.22 5.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.944 0.402 . . . . 0.0 110.345 -179.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.16 72.7 9.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.237 0.542 . . . . 0.0 111.134 178.172 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.72 -48.17 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 -179.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -81.23 113.47 19.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 174.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.493 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . . . -105.78 156.05 18.69 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.835 0.35 . . . . 0.0 111.011 -176.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.4 m -134.42 141.73 46.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.041 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.581 ' HB3' HD21 ' A' ' 50' ' ' LEU . . . -108.06 126.01 52.24 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.935 0.398 . . . . 0.0 110.454 176.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.731 ' HZ2' ' HB2' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -80.77 166.42 21.0 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.694 175.758 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.528 ' HB2' HD12 ' A' ' 12' ' ' LEU . . . -50.72 -38.42 47.18 Favored 'General case' 0 C--N 1.329 -0.297 0 O-C-N 123.433 0.458 . . . . 0.0 111.813 180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.3 -37.31 80.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.592 179.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.83 ' HG ' HD13 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -82.77 -23.24 34.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.71 -178.292 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.4 mt -63.88 -40.26 88.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 173.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -83.74 -4.34 58.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.118 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.765 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -81.7 -53.46 6.2 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 120.972 0.415 . . . . 0.0 110.58 -179.245 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.609 HD23 HD11 ' A' ' 50' ' ' LEU . 6.7 mp -110.98 -21.92 11.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.015 -176.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.41 46.09 6.64 Favored Glycine 0 CA--C 1.511 -0.186 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.275 -176.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.553 HD23 ' HB3' ' A' ' 80' ' ' ALA . 0.0 OUTLIER -76.79 147.18 37.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -174.036 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.84 14.9 5.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.328 174.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.553 ' HB3' HD23 ' A' ' 78' ' ' LEU . . . -79.1 -25.65 43.01 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.023 0.44 . . . . 0.0 111.09 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.472 ' HG ' HD11 ' A' ' 47' ' ' LEU . 8.1 mt -109.68 4.13 21.66 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.704 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -116.71 138.24 47.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.353 0.597 . . . . 0.0 110.819 -176.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.609 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 6.8 t0 -119.62 144.12 47.3 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 175.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -103.94 112.15 25.0 Favored 'General case' 0 C--N 1.316 -0.854 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.067 -174.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.736 ' HG1' HG21 ' A' ' 90' ' ' VAL . 39.0 p -107.46 -169.36 1.52 Allowed 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.963 174.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.8 pm0 -61.62 -24.44 66.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.604 178.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.35 -34.41 31.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.727 0.299 . . . . 0.0 111.092 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 143.48 -160.03 27.6 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.115 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_exo -71.92 97.55 0.83 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.207 2.604 . . . . 0.0 111.463 175.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.736 HG21 ' HG1' ' A' ' 85' ' ' THR . 0.0 OUTLIER -113.01 -174.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.899 -175.722 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.418 ' SG ' ' HE1' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -67.69 127.66 33.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.084 0.469 . . . . 0.0 110.832 -177.793 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.609 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 6.5 tptp -73.53 -36.73 65.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.622 -178.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -144.37 -78.53 0.2 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -170.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.69 ' HB ' ' HB2' ' A' ' 35' ' ' CYS . 4.6 mt -110.92 136.18 47.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.404 -170.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 13.2 m -101.76 139.65 22.36 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 120.738 0.304 . . . . 0.0 110.853 177.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.519 ' HB1' ' HA ' ' A' ' 107' ' ' ALA . . . -155.24 166.92 32.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.134 0.492 . . . . 0.0 111.81 -178.52 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.5 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.8 m -113.2 117.71 32.65 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 173.468 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.685 ' O ' ' HA ' ' A' ' 31' ' ' SER . 39.8 t -123.6 124.46 26.21 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.504 -175.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -84.26 127.9 4.06 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.815 2.343 . . . . 0.0 113.028 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.437 ' CD ' ' HZ3' ' A' ' 69' ' ' LYS . 0.7 OUTLIER -73.33 105.37 4.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.042 0.448 . . . . 0.0 110.519 175.074 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.482 ' C ' ' HG1' ' A' ' 102' ' ' THR . . . 169.54 -80.44 0.1 OUTLIER Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 176.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.482 ' HG1' ' C ' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -160.51 161.32 32.74 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 122.728 0.411 . . . . 0.0 109.892 176.724 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.556 HG22 ' H ' ' A' ' 104' ' ' ASN . 23.7 m 79.76 150.66 0.11 Allowed 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.779 0.674 . . . . 0.0 110.733 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.572 ' HA ' ' CB ' ' A' ' 57' ' ' ASN . 0.3 OUTLIER -71.28 173.9 7.15 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -168.679 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.576 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.15 142.83 44.13 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.496 -177.624 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -99.16 127.91 51.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 121.061 0.458 . . . . 0.0 110.031 -177.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.519 ' HA ' ' HB1' ' A' ' 96' ' ' ALA . . . -94.48 136.01 35.27 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.818 177.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.71 -0.99 9.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.275 0.559 . . . . 0.0 111.271 -178.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . 0.429 ' HB3' HG21 ' A' ' 94' ' ' ILE . 17.7 t0 . . . . . 0 C--N 1.318 -0.786 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.283 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.709 HD11 ' HB3' ' A' ' 70' ' ' ALA . 7.9 mp . . . . . 0 N--CA 1.457 -0.108 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 70.68 -24.98 0.16 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.808 0.843 . . . . 0.0 111.393 -178.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.551 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -170.57 -42.57 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.3 m 64.69 -74.45 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.416 -177.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.643 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . 52.99 -91.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.052 0.541 . . . . 0.0 111.307 -177.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.817 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . . . -63.15 -32.18 73.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.804 0.335 . . . . 0.0 110.526 177.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.52 ' HE2' ' SG ' ' A' ' 34' ' ' CYS . 28.5 t80 -68.71 -32.66 72.61 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.158 0.504 . . . . 0.0 110.05 176.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.34 -37.04 80.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.587 177.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.817 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 23.1 mttt -64.9 -36.96 86.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.38 0.609 . . . . 0.0 109.403 174.616 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -59.99 -40.87 90.63 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.309 174.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.21 -16.64 61.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.467 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.56 -40.44 11.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.658 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -75.83 -27.88 61.91 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.757 -177.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -114.33 146.23 40.78 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.586 0.231 . . . . 0.0 110.393 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.55 92.93 9.07 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 121.398 0.618 . . . . 0.0 111.208 -178.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.541 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -160.3 131.23 5.64 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 170.469 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -111.36 -175.15 2.63 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.517 -174.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.7 t -58.34 117.07 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.174 0.511 . . . . 0.0 109.849 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.488 ' O ' ' HA ' ' A' ' 99' ' ' PRO . . . 113.82 -23.68 12.87 Favored Glycine 0 N--CA 1.441 -1.001 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 -174.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.96 4.4 5.35 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.81 0.338 . . . . 0.0 111.2 178.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.447 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 5.3 tt -96.79 129.52 46.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.887 0.375 . . . . 0.0 110.807 -177.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.75 172.81 15.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.223 0.535 . . . . 0.0 111.929 -176.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.553 ' HB2' HD11 ' A' ' 81' ' ' LEU . 55.9 m -124.54 142.09 51.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.741 170.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -117.2 145.02 44.15 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.706 ' HB2' ' HB3' ' A' ' 81' ' ' LEU . 13.2 t-20 -131.6 159.74 37.37 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.942 0.401 . . . . 0.0 111.031 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -54.5 142.06 52.33 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.612 175.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.541 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 11.5 Cg_endo -55.39 -38.54 93.8 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 123.107 2.538 . . . . 0.0 112.795 -175.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.37 -16.69 64.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.963 0.411 . . . . 0.0 111.937 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -102.81 -42.68 5.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.526 179.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.66 -25.81 65.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.054 0.454 . . . . 0.0 110.841 178.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.541 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -104.84 14.29 29.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.4 179.499 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -62.32 -26.01 68.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.013 -175.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 1.026 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 14.6 t70 -122.03 150.85 41.51 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.588 0.232 . . . . 0.0 110.394 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.98 -35.03 79.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.216 -179.037 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.477 HD22 HD12 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -92.32 -15.99 26.64 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.464 179.851 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 1.026 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 5.0 tp -60.98 -40.94 95.35 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.085 -178.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -29.84 69.91 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.12 -177.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -84.59 -29.84 28.66 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.726 -0.749 . . . . 0.0 111.754 177.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.477 HD12 HD22 ' A' ' 46' ' ' LEU . 0.3 OUTLIER -68.53 -20.81 64.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.919 0.39 . . . . 0.0 110.972 179.275 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.763 HD13 HD22 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -56.57 -30.99 63.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.236 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.576 ' HA3' ' HB2' ' A' ' 56' ' ' LEU . . . -137.24 100.07 0.31 Allowed Glycine 0 N--CA 1.441 -1.031 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.033 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.525 ' HB3' HD12 ' A' ' 72' ' ' LEU . . . -75.1 55.14 0.72 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.107 0.479 . . . . 0.0 110.481 177.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 164.61 -118.08 0.79 Allowed Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.556 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.538 ' O ' HG23 ' A' ' 102' ' ' THR . 4.5 mp -120.02 52.89 1.1 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.933 0.397 . . . . 0.0 110.199 -177.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.576 ' HB2' ' HA3' ' A' ' 52' ' ' GLY . 0.3 OUTLIER -88.36 166.9 13.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.269 0.557 . . . . 0.0 111.828 -175.816 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.417 ' HB3' ' O ' ' A' ' 103' ' ' THR . 45.7 t30 -132.83 -179.13 5.29 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.384 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -101.64 -153.56 25.74 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.502 -0.856 . . . . 0.0 112.684 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.839 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 9.5 tp -67.38 143.47 56.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.561 0.22 . . . . 0.0 110.842 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.1 m -59.34 94.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.524 -179.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.62 -13.86 63.67 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.6 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.839 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 6.7 t-20 -99.72 92.22 5.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.021 0.439 . . . . 0.0 110.934 -177.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -76.14 72.22 2.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.049 176.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -179.46 -48.13 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.34 130.84 37.14 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.702 0.287 . . . . 0.0 110.397 176.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.717 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . . . -117.02 164.58 14.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.204 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.437 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 0.2 OUTLIER -129.36 127.96 42.11 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 120.822 0.344 . . . . 0.0 110.169 -178.46 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.49 ' CB ' HD12 ' A' ' 81' ' ' LEU . . . -109.43 148.82 30.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.983 178.07 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 32' ' ' ILE . 1.5 mppt? -92.46 168.25 11.4 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.614 -175.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.709 ' HB3' HD11 ' A' ' 12' ' ' LEU . . . -61.15 -32.62 72.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.197 -179.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.11 -48.6 77.84 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 176.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.525 HD12 ' HB3' ' A' ' 53' ' ' ALA . 0.1 OUTLIER -57.78 -40.45 79.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.786 177.172 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.914 ' HA ' ' HB2' ' A' ' 78' ' ' LEU . 11.4 mt -60.73 -47.82 91.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.63 179.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.95 -30.64 70.83 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.1 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.553 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -62.58 -53.82 48.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.538 -171.231 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.553 HD11 ' HB3' ' A' ' 75' ' ' GLN . 0.5 OUTLIER -138.67 25.53 2.59 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -171.247 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.502 ' O ' ' HG ' ' A' ' 79' ' ' LEU . . . 67.27 51.24 39.34 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 119.774 -1.203 . . . . 0.0 111.5 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.914 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 0.1 OUTLIER -73.53 72.57 1.4 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -174.227 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.781 ' HA ' ' HB ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -87.85 20.93 2.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.84 0.352 . . . . 0.0 110.905 178.092 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.1 -27.56 68.84 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.265 0.555 . . . . 0.0 110.558 179.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.763 HD22 HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -132.52 13.09 4.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.123 179.502 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.781 ' HB ' ' HA ' ' A' ' 79' ' ' LEU . 53.8 t -115.36 137.3 49.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.615 -173.175 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.403 ' N ' HG11 ' A' ' 82' ' ' VAL . 10.4 t70 -118.99 148.95 42.43 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 175.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 30.7 t-80 -109.87 115.49 29.91 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.089 -0.645 . . . . 0.0 111.65 -176.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.492 ' HB ' ' OE2' ' A' ' 87' ' ' GLU . 6.4 p -108.29 -173.92 2.39 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.466 174.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.47 -27.19 65.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.058 0.456 . . . . 0.0 110.051 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.643 ' HB3' ' HB3' ' A' ' 16' ' ' ALA . 1.9 mp0 -68.33 -24.39 64.82 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.015 176.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 129.47 -158.54 22.17 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.418 178.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -73.79 120.21 6.29 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 123.188 2.592 . . . . 0.0 111.53 176.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -137.56 166.86 23.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.282 -175.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 9.0 m -67.09 139.02 57.54 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.217 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.9 tttp -75.93 -49.85 16.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.643 -175.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -129.9 -86.0 0.53 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -170.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 5.6 mt -85.52 132.73 31.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.036 -168.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -94.5 123.79 46.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.386 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.437 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . . . -153.33 151.73 30.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.527 -178.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.541 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 3.7 m -105.45 123.59 48.14 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.281 0.562 . . . . 0.0 109.699 178.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 26.6 t -130.31 128.57 22.71 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.983 -172.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.488 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 10.5 Cg_exo -70.91 141.41 40.51 Favored 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.786 2.324 . . . . 0.0 112.275 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -88.2 103.99 16.29 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 171.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.497 ' H ' HD11 ' A' ' 56' ' ' LEU . . . 165.09 -78.65 0.13 Allowed Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.538 HG23 ' O ' ' A' ' 55' ' ' LEU . 0.3 OUTLIER -155.33 -174.81 5.13 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.54 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.417 ' O ' ' HB3' ' A' ' 57' ' ' ASN . 23.8 p 62.99 178.22 0.15 Allowed 'General case' 0 C--O 1.235 0.302 0 O-C-N 124.177 0.923 . . . . 0.0 112.449 178.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -93.02 173.96 7.47 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.721 -168.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.502 ' O ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -112.72 143.01 44.67 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.446 -176.308 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -87.46 141.82 13.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.917 0.389 . . . . 0.0 110.46 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -105.18 124.34 49.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.97 0.414 . . . . 0.0 110.902 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.406 ' H ' HG23 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -101.39 18.71 3.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.504 0.669 . . . . 0.0 109.828 178.891 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 48.0 t0 . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.208 178.461 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.477 HD11 ' HB3' ' A' ' 70' ' ' ALA . 4.8 mp . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 54.04 67.09 1.06 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.607 -176.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 37.4 m 79.28 -37.74 0.19 Allowed 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.245 -178.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.592 ' HB3' ' HB3' ' A' ' 18' ' ' PHE . 0.9 OUTLIER 54.41 53.11 11.29 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.855 0.36 . . . . 0.0 111.689 174.748 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.16 -58.08 10.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.209 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.62 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . . . -73.84 -16.96 61.12 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.249 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.592 ' HB3' ' HB3' ' A' ' 15' ' ' SER . 80.3 t80 -79.51 -35.75 39.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.863 0.364 . . . . 0.0 110.474 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.88 -30.43 71.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.862 0.363 . . . . 0.0 110.796 176.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.62 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 46.4 mttt -69.29 -20.47 63.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.399 0.618 . . . . 0.0 109.711 176.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.92 -46.12 10.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.401 177.521 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.79 -18.43 64.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.892 -171.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.1 -21.0 60.83 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.669 -177.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -101.36 3.5 54.36 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.39 -0.91 . . . . 0.0 112.75 -178.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.407 HG23 ' HB ' ' A' ' 108' ' ' VAL . 0.0 OUTLIER -121.99 134.25 54.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.933 0.366 . . . . 0.0 111.815 -175.381 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.48 96.97 4.84 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.178 174.597 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.581 ' SG ' ' HA ' ' A' ' 32' ' ' ILE . 0.5 OUTLIER -150.67 172.61 15.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.507 -179.289 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -123.85 159.39 29.71 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.739 -0.21 . . . . 0.0 110.589 -173.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 p -65.72 120.05 11.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.451 0.643 . . . . 0.0 110.144 178.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.84 -38.89 2.92 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.453 -175.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.98 -1.62 57.8 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.032 0.444 . . . . 0.0 110.925 178.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.581 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 2.0 tt -80.25 134.47 27.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.63 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -144.14 173.03 12.09 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.877 0.846 . . . . 0.0 113.115 -167.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 28.4 t -122.4 133.49 54.63 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.295 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.415 ' HB2' ' HB1' ' A' ' 96' ' ' ALA . 1.3 t -117.47 157.58 26.0 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.942 ' HB2' HD21 ' A' ' 81' ' ' LEU . 8.7 t-20 -149.07 159.33 44.33 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.743 -175.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.82 135.62 55.98 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.641 174.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.703 ' HG3' ' HG ' ' A' ' 65' ' ' SER . 74.5 Cg_exo -47.29 -46.76 18.94 Favored 'Trans proline' 0 C--O 1.22 -0.388 0 C-N-CA 123.576 2.851 . . . . 0.0 113.834 -172.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.546 ' HA ' ' ND2' ' A' ' 42' ' ' ASN . . . -60.93 -9.41 4.17 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -173.628 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.575 ' O ' ' HB2' ' A' ' 43' ' ' ASN . 4.6 tt0 -112.49 -41.36 3.88 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.68 HG22 HD12 ' A' ' 81' ' ' LEU . 2.5 m -59.28 -42.89 92.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.957 0.884 . . . . 0.0 110.584 171.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.546 ' ND2' ' HA ' ' A' ' 39' ' ' ALA . 0.0 OUTLIER -87.8 11.06 16.45 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.885 -175.243 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.575 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 1.8 t-20 -51.55 -34.8 38.13 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.968 -174.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 1.033 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 28.5 t70 -116.13 147.38 41.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.872 0.368 . . . . 0.0 110.997 178.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -40.52 97.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.134 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.28 -29.05 26.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.752 0.311 . . . . 0.0 110.319 -178.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 1.033 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -55.12 -32.94 62.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.574 173.346 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.84 -9.8 32.23 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.443 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -116.52 -8.89 11.99 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 172.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 1.2 tp -84.06 -19.99 33.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.976 0.417 . . . . 0.0 110.964 -176.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.406 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -67.24 -21.61 65.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.415 -179.091 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.13 91.77 0.28 Allowed Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.457 ' H ' HD22 ' A' ' 72' ' ' LEU . . . -58.49 -30.75 67.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.767 0.318 . . . . 0.0 111.757 -174.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -96.14 29.73 9.65 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.694 -179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.0 mt 61.59 54.95 2.88 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.4 0.619 . . . . 0.0 109.8 -175.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 103' ' ' THR . 0.5 OUTLIER -80.89 -161.97 0.44 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.229 -176.498 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.443 ' H ' ' CG ' ' A' ' 56' ' ' LEU . 7.9 t-20 -133.03 -177.17 4.39 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.234 -174.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.675 ' HA2' ' HB3' ' A' ' 66' ' ' ALA . . . -95.52 -144.2 16.24 Favored Glycine 0 C--N 1.314 -0.645 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -176.174 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.776 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -66.59 155.03 38.94 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 175.074 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.455 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 1.6 t -61.33 100.49 0.13 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.013 0.435 . . . . 0.0 111.322 -178.077 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.01 -0.4 69.25 Favored Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.142 -179.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.776 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 24.1 t-20 -128.95 97.04 4.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.109 0.481 . . . . 0.0 110.257 -176.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.06 71.09 10.26 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.334 0.588 . . . . 0.0 111.072 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -167.23 -50.92 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.134 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.703 ' HG ' ' HG3' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -89.75 79.87 6.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.139 0.495 . . . . 0.0 109.862 174.312 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.675 ' HB3' ' HA2' ' A' ' 58' ' ' GLY . . . -86.7 164.19 16.9 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.199 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.787 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -131.86 153.03 50.62 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.578 -179.028 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.629 ' HB1' HD13 ' A' ' 81' ' ' LEU . . . -116.67 138.74 51.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.244 -178.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.796 ' HE3' HD21 ' A' ' 72' ' ' LEU . 0.0 OUTLIER -88.28 165.45 15.01 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.962 -177.083 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.477 ' HB3' HD11 ' A' ' 12' ' ' LEU . . . -62.33 -25.31 67.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.108 0.48 . . . . 0.0 110.96 -179.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -32.39 70.24 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.441 0.639 . . . . 0.0 109.577 177.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.796 HD21 ' HE3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -73.9 -30.82 62.8 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.574 178.992 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.5 mt -67.87 -35.68 73.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.597 176.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -74.8 -31.43 61.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.933 177.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.08 -52.83 6.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.824 -176.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.52 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 2.8 mm? -105.64 -45.81 4.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.443 -173.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.54 49.59 5.1 Favored Glycine 0 CA--C 1.518 0.279 0 C-N-CA 119.994 -1.098 . . . . 0.0 112.533 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.502 ' H ' ' HG ' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -77.59 106.68 9.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.893 0.378 . . . . 0.0 110.978 -179.239 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.527 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -66.87 -18.29 65.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.938 -177.909 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.73 -21.65 64.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.809 0.337 . . . . 0.0 111.357 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.942 HD21 ' HB2' ' A' ' 36' ' ' ASN . 1.9 mt -123.45 28.6 6.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.291 0.567 . . . . 0.0 111.298 -176.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 2.0 p -142.44 145.41 23.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.313 176.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.595 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 9.8 t70 -122.88 171.09 9.47 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.05 177.456 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.31 80.29 1.79 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.143 0.497 . . . . 0.0 111.223 -174.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.6 t -78.86 171.81 14.65 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 172.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -51.4 -38.98 56.23 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -176.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -88.91 48.35 1.62 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.0 0.429 . . . . 0.0 111.886 -176.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.44 -175.78 49.56 Favored Glycine 0 CA--C 1.522 0.482 0 CA-C-N 115.82 -0.627 . . . . 0.0 113.993 172.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -62.96 138.09 66.14 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.985 2.456 . . . . 0.0 111.547 175.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.445 HG12 ' HB1' ' A' ' 17' ' ' ALA . 0.3 OUTLIER -149.51 173.43 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.152 -172.815 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 14.1 t -67.64 143.3 56.07 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 174.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.595 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 2.8 tttp -78.24 -46.3 20.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.38 -176.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.492 ' HB3' HG13 ' A' ' 94' ' ' ILE . 4.5 m-20 -142.89 -82.14 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.029 0.442 . . . . 0.0 111.948 -172.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.492 HG13 ' HB3' ' A' ' 93' ' ' ASN . 2.1 mt -96.65 130.31 45.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.237 -170.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.3 p -83.42 138.06 19.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.668 0.27 . . . . 0.0 110.371 176.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.49 ' HA ' HG21 ' A' ' 108' ' ' VAL . . . -148.68 164.18 35.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.017 0.437 . . . . 0.0 111.926 -175.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.55 122.28 46.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.314 175.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.787 ' SG ' ' HB2' ' A' ' 67' ' ' CYS . 57.0 m -132.71 127.58 20.49 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.516 -173.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -86.89 178.11 3.8 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.118 1.879 . . . . 0.0 110.965 173.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.431 ' HA ' HD11 ' A' ' 56' ' ' LEU . 1.0 OUTLIER -123.94 157.52 34.12 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 168.99 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 102.26 -45.15 1.4 Allowed Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.865 -178.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.714 HG21 ' HG1' ' A' ' 103' ' ' THR . 10.5 t -177.92 174.97 1.36 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.714 ' HG1' HG21 ' A' ' 102' ' ' THR . 0.6 OUTLIER 68.52 -175.11 0.2 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.594 176.672 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.672 ' H ' HG23 ' A' ' 103' ' ' THR . 0.3 OUTLIER -104.91 -178.9 3.79 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.079 -164.016 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 68.6 m -112.52 143.48 43.6 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.858 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 86.9 t -103.71 113.33 40.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.176 175.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.98 118.32 18.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 174.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.49 HG21 ' HA ' ' A' ' 96' ' ' ALA . 0.1 OUTLIER -96.05 17.61 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.806 -170.575 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 43.0 t0 . . . . . 0 C--N 1.32 -0.682 0 CA-C-O 121.556 0.693 . . . . 0.0 110.191 174.267 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.425 ' C ' ' H ' ' A' ' 14' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.263 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 74.76 -44.47 0.55 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.212 -172.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.432 ' O ' ' HB2' ' A' ' 15' ' ' SER . 0.5 OUTLIER -158.44 -40.16 0.06 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.79 -177.961 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' THR . 2.7 m 69.75 -69.32 0.17 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.513 -177.299 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 47.26 -92.58 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.475 0.71 . . . . 0.0 112.154 178.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.508 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . . . -62.9 -30.53 71.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.191 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -67.12 -27.6 67.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 110.305 177.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.87 -20.85 60.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.539 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.508 ' HD3' ' HA ' ' A' ' 17' ' ' ALA . 5.0 mtpp -71.83 -26.84 62.54 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.34 -36.57 19.16 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 113.893 -1.503 . . . . 0.0 110.541 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.67 -14.0 61.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.055 -174.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -109.15 16.77 22.25 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.445 0.641 . . . . 0.0 110.442 175.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -115.86 -27.67 2.92 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.22 174.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.572 HG21 HG21 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -103.67 142.22 34.71 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.607 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -91.12 96.7 10.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.932 0.396 . . . . 0.0 110.741 178.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 81.6 m -148.92 -179.04 6.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -98.73 159.87 14.66 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.457 ' H ' HG22 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -64.12 -49.48 81.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 120.798 0.332 . . . . 0.0 111.581 -178.113 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.21 -27.67 57.46 Favored Glycine 0 CA--C 1.509 -0.3 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.803 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -100.77 46.17 0.95 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.717 0.294 . . . . 0.0 111.218 -175.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.3 tt -112.32 138.84 39.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 174.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.709 ' HB2' ' HB3' ' A' ' 67' ' ' CYS . . . -146.54 155.32 42.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.536 0.684 . . . . 0.0 112.626 -171.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.6 m -109.88 133.23 53.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.637 174.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.402 ' SG ' ' HB1' ' A' ' 96' ' ' ALA . 0.0 OUTLIER -123.13 165.13 17.36 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.6 -178.387 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.521 ' N ' HD22 ' A' ' 81' ' ' LEU . 3.2 t30 -149.29 161.16 42.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.71 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -49.02 127.36 14.73 Favored Pre-proline 0 C--O 1.237 0.398 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.572 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.454 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 31.4 Cg_exo -47.93 -47.45 18.93 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 123.815 3.01 . . . . 0.0 113.925 -178.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.51 -20.58 56.49 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -173.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -102.91 -48.57 4.03 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.033 0.444 . . . . 0.0 109.839 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.703 HG21 HD23 ' A' ' 81' ' ' LEU . 88.1 m -59.31 -35.95 74.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.564 177.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.454 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.4 m-80 -103.88 14.69 30.29 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.316 -173.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -69.08 -21.64 64.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.217 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.928 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.0 t70 -103.66 152.76 21.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.495 179.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.91 -29.41 44.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.743 0.306 . . . . 0.0 111.441 -177.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.477 HD21 HD12 ' A' ' 50' ' ' LEU . 9.6 tp -90.03 -36.98 14.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.698 0.285 . . . . 0.0 110.493 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.928 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.4 OUTLIER -50.47 -38.69 45.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.67 178.058 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -28.18 69.64 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.573 -176.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -95.31 -25.1 14.66 Favored Glycine 0 C--N 1.33 0.207 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.626 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.477 HD12 HD21 ' A' ' 46' ' ' LEU . 1.2 tp -63.64 -32.89 74.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.969 0.414 . . . . 0.0 110.623 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.561 ' HA ' HD13 ' A' ' 78' ' ' LEU . 7.6 mt -60.53 -39.89 89.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.631 177.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.673 ' HA2' ' HG ' ' A' ' 56' ' ' LEU . . . -87.08 67.6 3.34 Favored Glycine 0 N--CA 1.443 -0.865 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.625 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -68.5 -23.85 64.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.435 0.636 . . . . 0.0 110.437 -176.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -124.55 25.66 5.89 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.046 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 63.74 39.26 8.65 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.471 0.653 . . . . 0.0 109.86 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.673 ' HG ' ' HA2' ' A' ' 52' ' ' GLY . 0.7 OUTLIER -80.32 179.66 7.57 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.038 177.392 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.928 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 7.9 t-20 -118.75 -177.27 3.27 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.37 -175.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -97.93 -143.06 14.1 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.453 -176.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.75 HD11 ' HB2' ' A' ' 107' ' ' ALA . 0.2 OUTLIER -65.54 148.89 50.97 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 178.957 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.583 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -57.24 90.28 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.64 -178.684 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.78 -10.34 70.54 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.86 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.522 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 57.9 t30 -117.55 105.93 12.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.284 0.564 . . . . 0.0 111.72 -174.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.44 131.5 42.65 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.359 178.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.48 -56.44 0.73 Allowed Glycine 0 CA--C 1.509 -0.325 0 C-N-CA 121.1 -0.571 . . . . 0.0 111.954 177.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.2 90.97 4.92 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.97 0.414 . . . . 0.0 110.42 178.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.02 160.74 16.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.079 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.709 ' HB3' ' HB2' ' A' ' 33' ' ' ALA . 64.7 m -126.55 130.84 51.34 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.061 0.457 . . . . 0.0 110.994 -178.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.626 ' HB2' ' CD1' ' A' ' 81' ' ' LEU . . . -105.49 125.83 51.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.578 178.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.437 ' NZ ' ' HA ' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -82.66 167.47 18.22 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.771 -178.555 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.506 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -60.55 -30.28 69.68 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.301 0.572 . . . . 0.0 109.997 175.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -23.12 63.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.511 176.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.801 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 1.3 tp -87.65 -24.03 24.05 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.501 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.506 HD12 ' HA ' ' A' ' 70' ' ' ALA . 0.5 OUTLIER -60.29 -38.01 75.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.152 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -90.52 -5.11 56.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.408 0.623 . . . . 0.0 110.704 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.801 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -87.38 -54.16 4.44 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.138 -176.798 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.592 HD21 ' HB2' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -126.73 -9.91 6.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.509 -176.495 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 67.33 47.93 60.92 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.407 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.561 HD13 ' HA ' ' A' ' 51' ' ' LEU . 65.6 mt -71.19 129.91 40.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.653 0.263 . . . . 0.0 111.264 -178.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.63 4.16 19.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.093 177.09 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.49 -29.56 62.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.098 -174.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.703 HD23 HG21 ' A' ' 41' ' ' THR . 0.0 OUTLIER -128.89 4.92 5.4 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.973 0.416 . . . . 0.0 111.355 -174.666 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 6.2 t -111.11 137.66 42.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.885 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.898 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 6.9 t0 -115.47 154.61 28.99 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.7 m80 -125.87 114.6 18.76 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.316 0.579 . . . . 0.0 110.179 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.07 -169.96 1.56 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.143 -177.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -72.63 -19.75 61.39 Favored 'General case' 0 C--N 1.323 -0.57 0 O-C-N 123.335 0.397 . . . . 0.0 111.0 -178.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -89.14 -14.05 37.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.01 177.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 128.85 -152.79 19.47 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.516 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -79.51 129.59 8.49 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 123.321 2.68 . . . . 0.0 111.91 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 3.1 m -149.55 -178.56 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.237 -175.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.92 133.7 43.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.237 177.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.898 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 8.1 tttp -74.98 -49.92 18.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.545 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -136.84 -74.91 0.42 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.149 -172.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.0 mt -98.93 138.63 22.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.602 -171.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.4 p -112.27 138.93 39.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.474 ' CB ' ' HA ' ' A' ' 107' ' ' ALA . . . -150.2 168.93 22.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.05 0.452 . . . . 0.0 111.867 -176.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -112.03 117.17 31.95 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 171.944 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.507 ' HA ' ' HB3' ' A' ' 105' ' ' CYS . 44.5 t -138.69 139.76 25.31 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.673 0.273 . . . . 0.0 111.735 -170.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -82.86 -178.42 3.88 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 123.35 2.7 . . . . 0.0 112.093 176.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.437 ' HA ' ' NZ ' ' A' ' 69' ' ' LYS . 3.2 tp10 -80.18 -30.63 38.82 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -177.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.57 ' HA2' ' HA ' ' A' ' 56' ' ' LEU . . . -178.82 64.56 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 119.532 -1.318 . . . . 0.0 113.202 -178.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -153.94 108.54 3.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.601 0.239 . . . . 0.0 110.471 175.084 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 54.61 -176.25 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.669 0.747 . . . . 0.0 112.52 -178.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.928 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -74.42 165.44 25.19 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.734 -178.009 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.507 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 2.5 m -111.03 143.16 42.16 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.002 -175.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.0 p -85.35 120.79 36.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.125 0.488 . . . . 0.0 111.254 -176.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.75 ' HB2' HD11 ' A' ' 59' ' ' LEU . . . -96.88 125.76 41.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.144 175.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.572 HG21 HG21 ' A' ' 25' ' ' THR . 0.1 OUTLIER -89.38 10.52 2.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.109 0.48 . . . . 0.0 110.945 -178.173 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.2 t0 . . . . . 0 C--N 1.322 -0.614 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.306 179.381 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.678 ' N ' HD21 ' A' ' 12' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.139 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.464 ' HB2' ' O ' ' A' ' 12' ' ' LEU . . . 70.88 -53.42 0.67 Allowed 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.59 0.756 . . . . 0.0 109.752 -167.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.447 ' C ' ' HG ' ' A' ' 15' ' ' SER . 0.0 OUTLIER -149.61 -34.12 0.19 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.344 175.819 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.52 ' CB ' ' HB2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER 62.53 32.34 16.57 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.398 -0.819 . . . . 0.0 112.096 175.467 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.1 -37.92 84.76 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.136 0.493 . . . . 0.0 110.073 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.37 -33.63 19.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.552 177.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.607 ' CD2' ' HG ' ' A' ' 12' ' ' LEU . 87.7 t80 -69.66 -44.35 70.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.453 -177.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.44 0.67 0.66 Allowed 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.466 ' HG3' ' OE1' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -73.37 -5.89 42.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.623 0.725 . . . . 0.0 109.112 176.178 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.462 ' HA ' ' OG1' ' A' ' 25' ' ' THR . 0.0 OUTLIER -82.88 -8.82 59.54 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.377 176.97 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -109.11 3.76 22.29 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.757 175.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.466 ' OE1' ' HG3' ' A' ' 20' ' ' LYS . 41.6 mt-10 -115.68 -75.97 0.58 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.734 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -70.07 -42.52 67.62 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.893 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.471 HG21 HG22 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -83.82 132.05 34.84 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.397 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.88 95.32 7.3 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.232 0.539 . . . . 0.0 110.681 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 60.7 m -144.56 -178.32 5.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.256 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -110.84 148.36 32.57 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.9 t -66.87 -47.43 82.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.912 0.387 . . . . 0.0 110.744 -177.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.73 18.51 5.81 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.322 177.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -152.42 38.0 0.54 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.107 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.501 HG22 ' HE2' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -96.57 136.56 27.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.087 -178.964 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.506 ' HB2' ' HB3' ' A' ' 98' ' ' CYS . . . -149.53 -179.72 7.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.18 0.514 . . . . 0.0 112.204 -175.001 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.548 ' SG ' ' HE1' ' A' ' 18' ' ' PHE . 64.8 m -131.81 144.82 51.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.814 175.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.404 ' HA ' ' HG ' ' A' ' 81' ' ' LEU . 0.9 OUTLIER -134.72 165.08 26.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.645 0.26 . . . . 0.0 110.568 -176.105 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.468 ' N ' HD12 ' A' ' 81' ' ' LEU . 33.7 t-20 -154.08 161.16 42.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.258 177.69 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.5 m -53.99 146.92 26.79 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.139 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.414 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 46.4 Cg_exo -56.58 -33.74 93.75 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 123.05 2.5 . . . . 0.0 113.004 -175.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.05 -14.87 63.32 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.61 -48.7 3.37 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.311 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.709 ' HA ' ' HB3' ' A' ' 80' ' ' ALA . 3.1 m -56.29 -36.28 68.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.468 178.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.8 m-80 -105.58 14.23 28.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.847 -174.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -62.53 -26.49 68.59 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.952 0.406 . . . . 0.0 111.178 -175.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.815 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 8.0 t70 -119.02 146.16 45.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.683 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -24.85 62.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.105 0.479 . . . . 0.0 111.122 -179.342 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.2 tp -90.83 -23.58 20.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.104 177.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.815 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.7 OUTLIER -60.01 -45.92 91.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.876 179.99 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.8 -32.87 74.64 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.931 -178.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -75.86 -22.3 74.78 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 121.011 -0.614 . . . . 0.0 111.778 176.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.727 ' HB3' HD13 ' A' ' 78' ' ' LEU . 0.7 OUTLIER -75.44 -26.17 58.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.038 0.447 . . . . 0.0 109.855 177.881 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.697 ' HG ' ' HB3' ' A' ' 66' ' ' ALA . 0.2 OUTLIER -67.33 -40.33 85.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.716 179.139 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.66 72.19 1.72 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.336 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.37 -17.04 61.86 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.165 0.507 . . . . 0.0 110.312 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.24 47.46 0.8 Allowed Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.619 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.9 mt 55.39 51.79 12.38 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.181 0.515 . . . . 0.0 110.743 -177.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.48 HD13 ' OE1' ' A' ' 100' ' ' GLU . 12.8 mt -88.84 172.27 9.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.887 -177.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.489 ' HB2' ' C ' ' A' ' 103' ' ' THR . 4.3 m-20 -114.59 -178.39 3.36 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.378 174.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -99.46 -131.88 7.49 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.346 -0.93 . . . . 0.0 111.025 178.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.802 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.3 OUTLIER -67.92 155.89 38.41 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 171.339 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.401 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -52.24 105.7 0.12 Allowed 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 120.84 0.352 . . . . 0.0 111.148 -178.128 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.14 33.26 85.27 Favored Glycine 0 C--N 1.335 0.506 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.414 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.802 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 25.1 t-20 -126.08 100.9 6.54 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.904 0.383 . . . . 0.0 110.399 -176.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.45 77.56 9.21 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.085 0.469 . . . . 0.0 111.105 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.07 -55.62 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.91 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.6 m -88.66 129.59 35.48 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 176.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.697 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . . . -131.82 153.96 49.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.592 0.234 . . . . 0.0 110.423 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.673 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 0.8 OUTLIER -118.09 135.55 54.13 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.272 0.558 . . . . 0.0 111.201 -174.343 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -105.71 146.52 29.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.294 177.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.502 ' HE3' ' HG2' ' A' ' 100' ' ' GLU . 1.6 mppt? -102.36 168.33 9.39 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.427 ' HB3' HD23 ' A' ' 12' ' ' LEU . . . -60.36 -36.14 77.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.019 0.437 . . . . 0.0 110.809 178.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.609 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -62.85 -27.7 69.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.517 176.861 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.539 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 4.0 mp -82.21 -25.55 34.1 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.709 -178.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.23 -36.68 77.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.045 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -100.05 4.08 44.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.767 177.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.609 ' HB2' ' O ' ' A' ' 71' ' ' SER . 1.0 OUTLIER -94.92 -53.89 3.67 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.114 -178.783 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.568 ' HB3' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -123.89 -30.98 3.46 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.964 -175.522 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.94 50.76 3.19 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.02 -1.086 . . . . 0.0 112.0 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.727 HD13 ' HB3' ' A' ' 50' ' ' LEU . 3.7 mm? -57.44 113.08 1.62 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.754 0.312 . . . . 0.0 110.976 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.27 6.32 48.57 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.189 -177.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.784 ' HB1' HD23 ' A' ' 47' ' ' LEU . . . -89.37 -40.84 12.48 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -175.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.655 HD11 HG23 ' A' ' 41' ' ' THR . 0.2 OUTLIER -99.21 -4.68 31.47 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.728 -171.749 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.514 HG21 ' O ' ' A' ' 78' ' ' LEU . 2.8 t -108.86 137.94 38.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.875 0.369 . . . . 0.0 111.023 -174.356 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.707 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 27.7 t0 -120.29 174.42 6.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.108 179.204 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 27.1 p80 -60.11 140.51 56.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.115 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.512 ' HB ' HG21 ' A' ' 90' ' ' VAL . 5.3 t -143.14 160.68 39.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.852 -177.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -115.29 16.18 16.85 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.436 0.636 . . . . 0.0 109.71 176.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -139.8 -93.48 0.17 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.42 179.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.62 160.35 17.1 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 175.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.483 ' O ' HD11 ' A' ' 12' ' ' LEU . 51.3 Cg_exo -52.21 128.84 28.8 Favored 'Trans proline' 0 N--CA 1.474 0.326 0 C-N-CA 122.791 2.328 . . . . 0.0 112.259 -176.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.512 HG21 ' HB ' ' A' ' 85' ' ' THR . 29.0 m -125.16 159.72 31.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.946 -175.234 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.4 m -66.84 142.52 57.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.066 0.46 . . . . 0.0 111.227 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.707 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 2.0 tttp -75.43 -37.92 60.1 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.692 -176.515 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 12.1 m-20 -146.63 -72.13 0.23 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.27 -0.423 . . . . 0.0 112.015 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 74.7 mt -86.87 126.68 40.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.566 -171.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 27.4 m -92.93 128.91 44.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.404 174.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.476 ' HB1' ' HA ' ' A' ' 107' ' ' ALA . . . -154.84 156.68 36.64 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.796 0.331 . . . . 0.0 111.097 -176.206 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.58 131.27 53.18 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 174.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.522 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 28.3 t -143.73 134.86 12.54 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.154 -172.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -85.26 155.8 10.97 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 122.488 2.126 . . . . 0.0 111.838 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.502 ' HG2' ' HE3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -100.55 127.63 46.86 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 176.221 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 100.41 -7.7 58.3 Favored Glycine 0 N--CA 1.44 -1.077 0 C-N-CA 120.745 -0.74 . . . . 0.0 113.379 176.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.76 121.15 10.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -172.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.489 ' C ' ' HB2' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 41.52 -135.11 0.28 Allowed 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.876 1.435 . . . . 0.0 114.876 168.708 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.451 ' H ' ' HB ' ' A' ' 103' ' ' THR . 0.3 OUTLIER -111.83 179.57 3.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.558 0.694 . . . . 0.0 112.599 -164.237 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.673 ' SG ' ' HB2' ' A' ' 67' ' ' CYS . 0.0 OUTLIER -118.47 154.98 31.6 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.735 -1.12 . . . . 0.0 111.052 -176.727 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.409 ' O ' HG21 ' A' ' 106' ' ' VAL . 2.3 m -103.76 137.92 30.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.348 178.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.476 ' HA ' ' HB1' ' A' ' 96' ' ' ALA . . . -104.57 142.04 35.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.087 -176.09 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.471 HG22 HG21 ' A' ' 25' ' ' THR . 0.0 OUTLIER -122.62 20.6 4.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.294 0.568 . . . . 0.0 111.21 -178.114 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 . . . . . 0 C--N 1.322 -0.613 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.86 -178.406 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.599 ' HG ' ' OG ' ' A' ' 15' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 121.017 0.436 . . . . 0.0 110.097 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.435 ' O ' ' HB ' ' A' ' 14' ' ' THR . . . 60.69 60.4 1.93 Allowed 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.551 177.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.435 ' HB ' ' O ' ' A' ' 13' ' ' ALA . 87.5 m 76.68 -48.9 0.56 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.412 -178.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.651 ' HB3' ' HB3' ' A' ' 18' ' ' PHE . 20.2 m 57.29 41.25 26.97 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.141 0.276 . . . . 0.0 111.108 179.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.38 -50.14 70.49 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.771 0.319 . . . . 0.0 111.348 -173.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -93.61 -19.09 21.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.956 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.651 ' HB3' ' HB3' ' A' ' 15' ' ' SER . 19.9 t80 -70.13 -24.57 63.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.963 0.411 . . . . 0.0 110.089 177.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.96 -37.21 86.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.706 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.19 -33.4 71.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.519 0.676 . . . . 0.0 109.323 177.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.85 -39.05 80.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.475 176.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.43 -16.06 63.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.748 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -101.96 0.89 36.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.816 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.9 -32.43 63.65 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.913 -0.66 . . . . 0.0 111.94 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.04 158.89 44.07 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 177.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.52 95.3 1.78 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.214 0.531 . . . . 0.0 111.592 -176.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.1 m -148.24 150.36 33.55 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.123 176.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.44 -164.93 2.14 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 p -57.17 127.55 16.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.142 0.496 . . . . 0.0 110.5 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.483 ' O ' ' HA ' ' A' ' 99' ' ' PRO . . . 106.37 -30.46 9.53 Favored Glycine 0 N--CA 1.445 -0.743 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.177 -178.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.6 p -124.02 -11.17 7.61 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.6 tt -83.06 125.8 40.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.408 0.623 . . . . 0.0 110.751 -177.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.489 ' HB3' ' HB3' ' A' ' 98' ' ' CYS . . . -150.49 178.27 9.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.063 -179.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.42 ' O ' HD23 ' A' ' 81' ' ' LEU . 12.2 m -125.8 137.84 53.8 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.221 173.563 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.475 ' C ' HD22 ' A' ' 81' ' ' LEU . 1.2 m -113.13 156.01 23.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.749 0.309 . . . . 0.0 110.824 -176.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.623 ' HB3' ' HG1' ' A' ' 41' ' ' THR . 16.6 t-20 -141.52 159.39 42.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.959 0.409 . . . . 0.0 111.276 -177.021 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.78 138.52 95.37 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.998 175.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.554 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 11.9 Cg_endo -55.01 -34.61 87.61 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.006 2.471 . . . . 0.0 112.798 -175.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.8 -8.3 42.08 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.048 0.451 . . . . 0.0 111.61 -178.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -108.25 -50.28 3.06 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.623 ' HG1' ' HB3' ' A' ' 36' ' ' ASN . 0.2 OUTLIER -61.57 -35.06 76.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.99 -1.004 . . . . 0.0 111.668 -179.658 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.554 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.7 m-80 -104.11 15.49 28.33 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.644 -172.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -58.91 -28.37 66.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.203 -177.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.921 ' HB3' ' HG ' ' A' ' 47' ' ' LEU . 15.0 t70 -122.52 146.16 47.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.191 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -22.33 62.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.815 -178.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.9 tp -90.38 -27.63 19.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.675 0.274 . . . . 0.0 110.299 178.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.921 ' HG ' ' HB3' ' A' ' 44' ' ' ASP . 19.2 mt -58.77 -40.6 84.4 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.643 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.47 ' HA ' HD22 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -64.87 -24.53 67.56 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.089 -178.056 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.55 -18.03 46.79 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.073 -0.584 . . . . 0.0 111.889 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.93 -18.14 48.13 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.166 0.508 . . . . 0.0 110.024 177.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.527 HD23 HG22 ' A' ' 41' ' ' THR . 0.1 OUTLIER -67.45 -43.19 81.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.696 176.847 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -104.16 86.85 0.53 Allowed Glycine 0 N--CA 1.442 -0.95 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.881 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.4 64.62 5.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.402 0.62 . . . . 0.0 109.559 174.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.36 -121.37 2.97 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 -175.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.525 ' HB3' HG21 ' A' ' 102' ' ' THR . 2.1 mt -111.92 47.59 1.04 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.069 0.462 . . . . 0.0 111.156 178.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.66 143.52 29.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.229 178.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -117.46 -177.56 3.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.711 -176.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -106.35 -142.42 10.84 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.599 -173.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.86 154.28 41.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.887 0.375 . . . . 0.0 111.14 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.0 p -67.93 89.4 0.28 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.905 177.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.87 -45.07 1.47 Allowed Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 116.053 -0.522 . . . . 0.0 112.521 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.48 113.36 12.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.992 0.425 . . . . 0.0 111.064 -177.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.51 114.72 21.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.752 178.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 137.74 -53.08 0.73 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.754 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.53 136.58 44.08 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 176.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.462 ' HB2' ' HG ' ' A' ' 51' ' ' LEU . . . -129.78 167.37 18.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.554 -178.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.441 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -125.43 130.14 51.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.188 178.5 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.827 ' HB2' HD12 ' A' ' 81' ' ' LEU . . . -105.34 136.23 45.27 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.795 0.331 . . . . 0.0 110.117 -178.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.465 ' HE2' ' HG3' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -100.99 155.73 17.81 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.094 -177.825 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.531 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -65.97 -23.61 66.63 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.122 -178.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -27.15 56.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.91 0.862 . . . . 0.0 109.17 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.6 -25.1 21.49 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.303 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.531 HD12 ' HA ' ' A' ' 70' ' ' ALA . 0.8 OUTLIER -63.2 -39.83 86.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.959 179.062 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -78.73 -2.99 42.01 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.17 0.51 . . . . 0.0 110.987 178.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -81.37 -39.16 25.45 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.724 -173.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.2 mp -143.84 14.81 1.73 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.707 -176.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.61 44.18 96.88 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.329 -0.939 . . . . 0.0 111.094 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.455 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 3.8 mp -53.47 126.41 21.36 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.183 -0.508 . . . . 0.0 111.143 -176.187 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.36 -1.8 11.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.772 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.536 ' HB3' HD12 ' A' ' 47' ' ' LEU . . . -79.78 -4.48 52.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.983 -174.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.827 HD12 ' HB2' ' A' ' 68' ' ' ALA . 0.3 OUTLIER -155.05 36.37 0.39 Allowed 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -172.955 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 90' ' ' VAL . 0.0 OUTLIER -140.15 137.96 37.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 120.999 0.428 . . . . 0.0 110.327 175.079 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.941 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 2.3 t0 -109.29 158.5 17.8 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 173.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -124.43 114.96 20.18 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 119.653 -0.819 . . . . 0.0 112.725 -170.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -107.95 -169.95 1.6 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.732 171.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -81.68 -7.62 59.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.72 0.295 . . . . 0.0 111.581 -175.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -104.43 12.95 32.76 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 120.862 0.363 . . . . 0.0 110.782 -178.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 115.42 -166.43 12.22 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.602 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -80.07 136.05 11.41 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 123.369 2.713 . . . . 0.0 111.323 176.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.459 ' O ' HG12 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -140.29 -170.76 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.289 -175.251 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -66.49 132.0 47.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.09 0.472 . . . . 0.0 110.802 -177.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.941 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 6.3 tptp -74.7 -35.29 62.74 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.408 -175.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -155.34 -74.34 0.11 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.603 -175.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.6 mp -98.89 138.11 24.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.39 -172.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 25.7 t -97.28 118.47 43.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.945 178.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -144.03 160.67 40.47 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.745 0.307 . . . . 0.0 110.99 -176.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.13 124.8 50.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.509 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 45.9 t -136.0 117.85 11.89 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.971 -172.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.483 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 89.2 Cg_endo -76.14 138.27 20.18 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 122.863 2.375 . . . . 0.0 112.058 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.465 ' HG3' ' HE2' ' A' ' 69' ' ' LYS . 3.8 tt0 -85.91 139.33 31.33 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.54 176.568 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 128.62 -63.41 0.62 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.976 -0.63 . . . . 0.0 111.55 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.525 HG21 ' HB3' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -167.28 176.18 6.88 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 122.635 0.374 . . . . 0.0 110.196 178.378 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.67 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.7 OUTLIER 73.84 166.11 0.29 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.672 0.749 . . . . 0.0 112.158 177.407 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.67 ' H ' HG22 ' A' ' 103' ' ' THR . 21.5 m-20 -79.01 173.18 12.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.644 -1.162 . . . . 0.0 112.224 -174.129 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.509 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -113.27 142.94 45.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.744 175.381 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -102.91 142.01 17.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.066 0.46 . . . . 0.0 111.215 -175.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -106.86 122.84 47.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.339 177.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.33 17.59 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.931 -177.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.834 -178.032 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.503 ' C ' ' H ' ' A' ' 14' ' ' THR . 3.8 mp . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 120.584 0.231 . . . . 0.0 110.39 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 69.48 -13.63 0.37 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.716 0.806 . . . . 0.0 111.888 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.503 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -164.26 -55.3 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 177.705 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.446 ' HB2' ' H ' ' A' ' 16' ' ' ALA . 0.3 OUTLIER 56.7 -96.69 0.07 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.991 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.588 ' HB2' ' OE1' ' A' ' 87' ' ' GLU . . . 53.46 -91.97 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.66 0.6 . . . . 0.0 111.507 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.598 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . . . -53.85 -38.78 65.02 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.059 0.457 . . . . 0.0 110.871 174.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.421 ' CD1' ' HA ' ' A' ' 90' ' ' VAL . 65.5 t80 -73.5 -35.18 65.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.539 177.43 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.429 ' O ' ' HG2' ' A' ' 23' ' ' GLU . . . -65.16 -21.06 66.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.577 -174.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.598 ' HE3' ' HA ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -52.4 -24.43 7.73 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.943 0.401 . . . . 0.0 111.115 177.033 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.93 -31.49 72.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.918 179.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.46 -17.25 27.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.21 -176.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.474 ' HG3' ' HA ' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -97.26 -45.31 6.55 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.871 -179.26 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.57 -37.07 21.42 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.377 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.94 153.43 28.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.871 0.367 . . . . 0.0 111.025 -177.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.66 98.35 11.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.999 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.2 m -135.5 170.8 15.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.746 176.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -111.16 164.83 12.45 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.053 -173.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.628 HG13 ' N ' ' A' ' 30' ' ' GLY . 0.3 OUTLIER -61.06 -35.52 65.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.243 -178.882 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.628 ' N ' HG13 ' A' ' 29' ' ' VAL . . . -107.14 35.97 4.69 Favored Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 176.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.742 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 15.6 m -145.84 -9.29 0.54 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.409 -0.395 . . . . 0.0 111.263 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.507 ' O ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -81.18 126.11 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.034 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.12 -179.33 6.95 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.336 0.589 . . . . 0.0 112.061 -169.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 7.8 t -136.86 141.07 42.78 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.124 172.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -122.61 151.66 41.23 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.082 -178.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -135.71 157.05 47.81 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.66 135.54 7.8 Favored Pre-proline 0 C--N 1.33 -0.252 0 O-C-N 124.05 0.843 . . . . 0.0 110.922 177.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -49.91 -38.68 48.78 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.589 2.859 . . . . 0.0 113.609 -174.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.45 -8.86 54.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.973 0.416 . . . . 0.0 111.663 -177.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -109.13 -35.37 6.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.143 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -42.22 81.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.611 0.72 . . . . 0.0 110.259 175.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -95.27 15.46 19.22 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.531 -178.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -58.72 -32.3 69.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.886 178.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.999 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 24.7 t70 -108.4 136.1 48.6 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.672 174.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -25.28 65.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.733 0.301 . . . . 0.0 111.573 -176.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.3 tp -91.78 -22.85 19.94 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.956 178.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.999 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.1 OUTLIER -55.92 -46.45 78.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.273 -178.362 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.8 -24.2 66.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.039 0.447 . . . . 0.0 111.358 -179.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -96.03 -5.89 59.37 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.579 -0.819 . . . . 0.0 111.74 177.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.78 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 1.3 tp -83.96 -33.52 24.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.826 0.346 . . . . 0.0 110.194 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.86 -32.54 63.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.362 178.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.644 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -84.9 69.04 3.39 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.551 -0.833 . . . . 0.0 111.996 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.27 55.46 2.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.419 0.628 . . . . 0.0 109.812 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 141.27 -112.42 0.77 Allowed Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.611 -0.996 . . . . 0.0 110.611 -175.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.72 60.29 1.03 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.159 0.504 . . . . 0.0 110.215 175.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.644 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 0.2 OUTLIER -87.08 142.13 28.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.165 178.768 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.544 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 1.0 OUTLIER -111.59 -178.0 3.33 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.382 -176.742 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -109.84 -155.12 15.34 Favored Glycine 0 C--O 1.227 -0.305 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.148 -175.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.447 ' HA ' HD23 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -65.7 146.45 54.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.794 0.33 . . . . 0.0 110.64 176.838 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.9 m -66.09 93.15 0.19 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.778 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 109.83 -58.87 0.37 Allowed Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.868 -178.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -71.71 99.43 2.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.034 0.445 . . . . 0.0 110.615 -179.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.73 70.27 8.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.394 0.616 . . . . 0.0 110.586 179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -166.72 -54.47 0.03 OUTLIER Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.536 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.69 120.28 14.43 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 175.222 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -115.74 142.16 47.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.559 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -110.98 128.95 56.01 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.593 -178.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.51 ' CB ' HD11 ' A' ' 81' ' ' LEU . . . -111.63 140.5 46.2 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.013 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.701 ' HD2' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -94.69 174.65 7.0 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.32 -174.733 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.26 -31.36 71.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.104 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.467 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.9 OUTLIER -67.13 -36.31 81.62 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.702 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.24 -36.16 61.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.494 178.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.8 mt -61.51 -41.73 91.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.295 0.569 . . . . 0.0 109.641 175.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -77.22 -7.36 55.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.001 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.467 ' HB2' ' O ' ' A' ' 71' ' ' SER . 2.0 tp-100 -95.03 -54.35 3.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.873 -177.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.78 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -122.87 -6.4 8.49 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -173.148 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 65.79 49.74 57.46 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.546 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.532 HD13 ' HB2' ' A' ' 76' ' ' LEU . 4.4 mp -70.95 97.5 1.44 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.735 0.302 . . . . 0.0 111.516 -176.75 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.78 ' HA ' HG11 ' A' ' 82' ' ' VAL . 0.0 OUTLIER -86.86 18.51 3.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.932 0.396 . . . . 0.0 111.323 179.743 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.4 -26.36 35.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.895 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.51 HD11 ' CB ' ' A' ' 68' ' ' ALA . 0.1 OUTLIER -126.03 -4.34 6.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.647 -178.309 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.78 HG11 ' HA ' ' A' ' 79' ' ' LEU . 1.9 p -104.68 141.33 20.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.21 0.529 . . . . 0.0 110.704 -177.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -129.37 174.92 9.18 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.465 177.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -133.67 107.76 8.14 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.951 0.405 . . . . 0.0 111.049 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.536 ' C ' ' H ' ' A' ' 87' ' ' GLU . 17.5 p -79.97 -168.82 1.76 Allowed 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 173.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -75.9 28.02 0.11 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.165 0.507 . . . . 0.0 110.403 173.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.588 ' OE1' ' HB2' ' A' ' 16' ' ' ALA . 1.4 mm-40 -126.39 -101.32 0.37 Allowed 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.501 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -135.58 -158.83 8.36 Favored Glycine 0 N--CA 1.445 -0.71 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 178.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -69.01 117.84 5.29 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.552 2.168 . . . . 0.0 111.12 176.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.495 HG22 HG22 ' A' ' 85' ' ' THR . 2.5 m -129.14 170.89 17.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.174 0.511 . . . . 0.0 111.74 -173.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.4 t -67.82 118.86 11.62 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.167 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 35.7 tttp -69.27 -30.15 68.2 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.114 -178.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.473 ' HB3' ' H ' ' A' ' 94' ' ' ILE . 0.6 OUTLIER -152.29 -105.84 0.05 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.142 0.496 . . . . 0.0 111.989 -173.407 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.473 ' H ' ' HB3' ' A' ' 93' ' ' ASN . 3.7 mt -76.61 126.6 37.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.781 -168.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -91.7 132.22 36.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 175.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -152.87 158.91 42.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.969 -176.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -105.85 116.71 32.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.966 0.412 . . . . 0.0 110.01 179.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.742 ' O ' ' HA ' ' A' ' 31' ' ' SER . 5.6 t -129.5 117.31 18.64 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.083 -173.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -73.71 146.1 37.9 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 122.648 2.232 . . . . 0.0 112.748 -178.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.4 ' CD ' ' HZ3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -89.3 129.11 35.9 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 173.272 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 130.09 -60.89 0.67 Allowed Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.792 -0.718 . . . . 0.0 111.91 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -169.36 174.79 5.85 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 122.917 0.487 . . . . 0.0 109.949 176.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 17.2 m 79.42 144.86 0.08 Allowed 'General case' 0 N--CA 1.462 0.159 0 O-C-N 124.043 0.84 . . . . 0.0 111.942 176.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.544 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -70.67 176.02 4.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.491 -1.231 . . . . 0.0 111.185 -178.049 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.477 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -110.96 141.96 43.7 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.898 -176.151 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.416 ' O ' HG23 ' A' ' 106' ' ' VAL . 3.3 m -88.07 145.75 7.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.289 177.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.92 121.45 45.27 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.891 0.377 . . . . 0.0 111.084 -177.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.28 30.52 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.564 177.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 34.3 p-10 . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.409 -175.224 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.469 0.512 0 CA-C-O 121.147 0.499 . . . . 0.0 110.834 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.14 -32.88 5.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.31 0.576 . . . . 0.0 110.221 178.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.29 -22.02 45.21 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.895 178.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.11 76.23 6.86 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.599 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.8 -28.36 65.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.315 0.579 . . . . 0.0 110.076 175.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.434 ' HB3' HG13 ' A' ' 90' ' ' VAL . . . -64.64 -33.44 75.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.397 177.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -72.67 -30.88 64.64 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.406 ' O ' ' HB3' ' A' ' 22' ' ' ALA . . . -66.51 -38.28 86.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.939 174.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -69.97 -36.88 75.55 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.688 0.756 . . . . 0.0 109.072 175.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.91 -25.24 68.06 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.787 176.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 19' ' ' ALA . . . -68.61 -14.96 63.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.45 . . . . 0.0 112.019 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -110.6 9.4 23.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.096 0.474 . . . . 0.0 110.383 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.28 -12.5 73.15 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 175.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.3 m -151.83 139.97 20.24 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 176.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.73 97.29 1.06 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.639 0.257 . . . . 0.0 110.97 -179.109 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.8 m -149.21 165.59 31.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.123 -177.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.52 ' O ' ' HB ' ' A' ' 32' ' ' ILE . 21.2 m120 -115.83 174.7 5.89 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 t -55.6 -42.99 71.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -178.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.24 9.43 72.22 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.423 -0.894 . . . . 0.0 113.131 -176.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.489 ' OG ' ' HB2' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -131.57 2.71 4.15 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.139 0.495 . . . . 0.0 110.958 -179.82 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.607 ' O ' HG22 ' A' ' 32' ' ' ILE . 0.9 OUTLIER -89.8 132.7 33.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.577 -179.484 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.652 ' HB3' ' HD2' ' A' ' 69' ' ' LYS . . . -145.07 156.16 43.75 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.485 0.659 . . . . 0.0 111.791 -175.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.794 ' HB3' HD22 ' A' ' 81' ' ' LEU . 44.3 t -108.64 130.85 55.32 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 115.107 -0.951 . . . . 0.0 108.514 172.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.629 ' SG ' ' HB2' ' A' ' 96' ' ' ALA . 60.1 m -116.68 154.43 30.6 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -178.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.618 ' OD1' ' HB ' ' A' ' 41' ' ' THR . 12.7 p30 -152.3 159.19 43.53 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.519 177.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.88 133.42 66.7 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.733 176.633 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.7 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 54.8 Cg_exo -49.86 -31.42 26.53 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.557 2.838 . . . . 0.0 113.607 -172.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.25 -19.93 49.92 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -177.012 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.96 -53.18 3.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.772 -177.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.618 ' HB ' ' OD1' ' A' ' 36' ' ' ASN . 0.4 OUTLIER -69.4 -25.07 63.96 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.541 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.7 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.4 m-80 -91.98 15.78 12.5 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.041 -177.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -49.4 -33.73 14.56 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.894 -179.175 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.781 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 6.2 t70 -119.3 152.35 36.87 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.678 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.0 -24.32 40.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.396 -175.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 tp -85.36 -36.28 20.85 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 175.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.781 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -52.3 -39.88 61.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.542 175.983 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.06 -18.25 65.14 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.145 -177.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -97.32 -25.88 10.63 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.065 -0.588 . . . . 0.0 111.837 176.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 94.2 mt -75.68 -9.04 58.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.771 0.319 . . . . 0.0 110.778 179.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.611 ' HG ' ' HB3' ' A' ' 66' ' ' ALA . 0.1 OUTLIER -65.81 -13.53 59.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.007 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.41 ' HA3' ' HB2' ' A' ' 56' ' ' LEU . . . -148.91 94.05 0.15 Allowed Glycine 0 N--CA 1.444 -0.815 0 N-CA-C 111.228 -0.749 . . . . 0.0 111.228 176.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.42 63.46 5.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.02 0.438 . . . . 0.0 111.459 -171.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 154.49 52.94 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.546 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 60.75 43.69 11.95 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.919 0.39 . . . . 0.0 111.619 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.708 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 0.1 OUTLIER -85.95 -174.36 5.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.935 0.398 . . . . 0.0 111.084 179.712 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.494 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 10.5 t-20 -132.88 -178.28 4.88 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.201 -178.478 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.524 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -107.42 -146.3 12.73 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.717 -0.674 . . . . 0.0 112.156 -177.282 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 12.9 tp -65.69 145.96 55.38 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.0 t -53.93 109.77 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.842 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.29 -51.08 4.44 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.81 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 24.6 t30 -81.32 94.35 6.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.307 0.575 . . . . 0.0 111.172 -176.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.73 129.08 38.68 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.324 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 131.95 -51.17 0.86 Allowed Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.793 178.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.89 68.82 7.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.878 0.371 . . . . 0.0 110.95 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.611 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . . . -79.95 137.77 36.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.745 176.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.3 m -110.83 141.51 44.09 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.109 0.48 . . . . 0.0 111.774 -174.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.593 ' H ' HD11 ' A' ' 81' ' ' LEU . . . -104.76 156.16 18.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.905 178.165 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.684 ' HE2' ' HG2' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -111.7 -178.42 3.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.201 -172.939 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.61 -37.96 83.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.695 0.283 . . . . 0.0 111.342 -177.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -41.39 94.9 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.473 0.654 . . . . 0.0 110.103 177.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.529 ' HA ' ' NE2' ' A' ' 75' ' ' GLN . 1.1 mp -72.57 -17.08 61.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.162 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -66.03 -34.09 67.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 173.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -101.01 -39.33 7.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.55 -174.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.529 ' NE2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -51.8 -29.68 20.08 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -174.8 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.14 -17.82 0.4 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 111.871 0.322 . . . . 0.0 111.871 -178.479 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.41 51.96 5.01 Favored Glycine 0 CA--C 1.519 0.304 0 C-N-CA 119.935 -1.126 . . . . 0.0 112.406 178.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.02 84.62 0.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.107 0.479 . . . . 0.0 111.018 -178.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.463 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -69.55 -6.24 29.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.565 -174.693 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -77.72 -16.49 58.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.825 0.345 . . . . 0.0 110.735 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.794 HD22 ' HB3' ' A' ' 34' ' ' CYS . 0.4 OUTLIER -105.54 -25.09 12.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.517 -175.907 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.44 138.85 24.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.0 0.428 . . . . 0.0 111.007 -177.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.467 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 5.8 t70 -117.85 159.26 23.37 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 174.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.506 ' CE1' ' HA2' ' A' ' 88' ' ' GLY . 23.8 t-80 -111.58 110.91 21.56 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.204 0.526 . . . . 0.0 110.858 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.821 ' HG1' HG23 ' A' ' 90' ' ' VAL . 19.3 p -97.07 -167.81 1.6 Allowed 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.093 177.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.464 ' H ' ' HG3' ' A' ' 86' ' ' GLU . 16.6 mt-10 -51.12 -44.06 61.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.531 177.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 48.9 mp0 -72.83 -75.42 0.14 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.842 0.353 . . . . 0.0 111.148 179.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.506 ' HA2' ' CE1' ' A' ' 84' ' ' HIS . . . -168.65 -151.48 7.18 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.617 -176.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -69.82 107.9 1.97 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 123.128 2.552 . . . . 0.0 111.703 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.821 HG23 ' HG1' ' A' ' 85' ' ' THR . 1.0 OUTLIER -125.61 -173.3 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.014 -176.726 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 50.1 t -67.72 134.13 50.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.41 177.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.467 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttt -73.65 -36.04 65.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.792 -178.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.514 ' HB3' HG13 ' A' ' 94' ' ' ILE . 4.8 m-80 -146.66 -95.22 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -171.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.514 HG13 ' HB3' ' A' ' 93' ' ' ASN . 3.5 mt -93.57 132.86 36.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.888 -168.701 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.49 130.82 36.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.501 177.03 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.629 ' HB2' ' SG ' ' A' ' 35' ' ' CYS . . . -154.52 175.8 13.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.051 0.453 . . . . 0.0 111.476 -178.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.97 125.69 54.68 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.555 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.62 ' HB3' ' HD2' ' A' ' 69' ' ' LYS . 15.3 t -144.22 129.01 9.38 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.18 -176.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.411 ' O ' HD23 ' A' ' 56' ' ' LEU . 67.5 Cg_endo -87.86 129.83 2.56 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 122.95 2.433 . . . . 0.0 112.818 -176.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.684 ' HG2' ' HE2' ' A' ' 69' ' ' LYS . 4.7 mm-40 -77.31 97.28 4.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.109 0.48 . . . . 0.0 110.691 176.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.447 ' O ' ' HB ' ' A' ' 102' ' ' THR . . . 169.67 -53.01 0.2 Allowed Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 177.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.708 ' HA ' ' HA ' ' A' ' 56' ' ' LEU . 5.8 t 177.07 -176.33 0.14 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 71.95 158.96 0.2 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.343 0.592 . . . . 0.0 111.099 -176.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.494 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 1.0 OUTLIER -76.17 173.88 10.79 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.498 -175.755 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.515 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -111.25 150.65 29.3 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.931 -179.467 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 6.0 m -106.6 133.48 51.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.891 0.377 . . . . 0.0 110.64 -177.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.98 119.55 39.67 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.316 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -114.28 13.44 8.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.062 0.458 . . . . 0.0 110.765 -178.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.324 -0.526 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.312 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.491 HD11 ' O ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.354 0 CA-C-O 121.107 0.479 . . . . 0.0 110.314 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.68 -28.72 69.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.629 -179.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.06 -27.06 61.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.184 0.516 . . . . 0.0 111.074 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -88.22 68.17 8.94 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.448 -176.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.51 -31.47 69.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.6 -29.45 70.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.934 174.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -84.47 -29.62 25.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.974 0.416 . . . . 0.0 110.466 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.43 -4.46 22.65 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.975 -178.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.47 -24.78 31.64 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 176.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.32 -27.34 61.47 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.858 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.12 -11.27 60.77 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.846 178.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -101.8 -47.54 4.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.103 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -72.08 -44.87 43.66 Favored Glycine 0 C--N 1.33 0.199 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.8 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.506 HG23 HG22 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -87.36 136.4 32.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.742 0.306 . . . . 0.0 110.918 -178.948 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.74 96.0 7.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.882 0.372 . . . . 0.0 111.618 -177.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 98.9 m -144.47 -178.85 6.19 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 176.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 31.8 t30 -102.66 134.78 45.46 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.4 p -62.57 -29.27 46.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 O-C-N 123.214 0.321 . . . . 0.0 111.334 -177.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -88.84 8.35 79.77 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.734 -0.746 . . . . 0.0 111.754 177.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.3 m -149.63 42.94 0.91 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.084 0.468 . . . . 0.0 110.408 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.499 ' O ' HG23 ' A' ' 32' ' ' ILE . 0.8 OUTLIER -97.65 140.14 18.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 176.397 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.518 ' HB1' ' HB3' ' A' ' 98' ' ' CYS . . . -148.67 160.88 42.73 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 121.194 0.521 . . . . 0.0 111.717 -173.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 21.5 m -114.6 131.98 56.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.158 173.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.404 ' HB2' ' HB ' ' A' ' 94' ' ' ILE . 2.8 m -122.23 164.94 16.98 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.297 -178.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.475 ' OD1' ' HB3' ' A' ' 92' ' ' LYS . 1.1 t30 -147.42 159.91 43.17 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.258 -179.571 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.05 142.1 37.1 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.786 175.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.5 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 83.9 Cg_exo -47.6 -44.84 24.99 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.858 3.038 . . . . 0.0 114.73 -173.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.47 -15.32 62.53 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -173.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.445 ' CD ' ' HZ3' ' A' ' 92' ' ' LYS . 4.7 mt-10 -98.59 -48.52 4.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.539 0.685 . . . . 0.0 109.631 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.626 HG23 HD23 ' A' ' 51' ' ' LEU . 3.6 m -61.13 -34.6 75.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.11 177.238 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.5 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.1 m-80 -104.93 15.2 28.17 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.779 -177.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -53.83 -40.16 66.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.481 -177.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 1.124 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.1 t70 -102.66 146.93 27.46 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.74 -179.343 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -34.19 77.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.86 -177.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.447 ' HA ' HD13 ' A' ' 46' ' ' LEU . 6.3 tp -92.28 -24.29 19.02 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.089 0.471 . . . . 0.0 110.736 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 1.124 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -58.85 -31.76 68.82 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.515 -177.613 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.678 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -63.01 -11.76 21.28 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -176.537 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -117.42 -21.49 4.37 Favored Glycine 0 C--N 1.331 0.301 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 172.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.2 mp -84.3 -7.21 59.4 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.702 ' HA ' ' HG ' ' A' ' 78' ' ' LEU . 0.3 OUTLIER -70.55 -9.0 55.7 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.301 0.572 . . . . 0.0 109.975 179.08 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.753 ' HA2' HD21 ' A' ' 72' ' ' LEU . . . -128.44 -125.99 2.82 Favored Glycine 0 N--CA 1.438 -1.224 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 176.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -168.76 -24.6 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.358 0.599 . . . . 0.0 109.669 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -126.1 -157.98 9.76 Favored Glycine 0 N--CA 1.443 -0.878 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 172.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.484 HD23 ' HA ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -75.53 64.79 1.67 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.182 0.515 . . . . 0.0 110.927 179.761 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.745 HD13 ' H ' ' A' ' 56' ' ' LEU . 0.0 OUTLIER -65.55 150.62 48.1 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.778 178.294 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -109.22 177.89 4.62 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 171.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -110.18 -154.18 14.38 Favored Glycine 0 CA--C 1.504 -0.603 0 C-N-CA 120.361 -0.923 . . . . 0.0 111.993 -173.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.651 ' HB3' ' HB2' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -65.46 139.54 58.52 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 178.37 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.2 m -56.77 96.48 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.5 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.11 19.12 56.46 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.883 178.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.651 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 1.1 t-20 -127.92 95.03 4.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.182 0.515 . . . . 0.0 109.92 178.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.33 88.4 3.14 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.612 -176.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 153.96 -43.74 0.6 Allowed Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.968 -0.634 . . . . 0.0 111.798 176.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.6 98.94 7.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.947 0.404 . . . . 0.0 110.675 179.007 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.51 171.58 9.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.982 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 79.4 m -134.68 140.08 45.73 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.273 -175.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.425 ' HB3' HD21 ' A' ' 81' ' ' LEU . . . -104.81 124.73 49.94 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.407 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.511 ' H ' ' HG2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -85.19 157.17 20.71 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.259 -175.465 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.84 -36.31 72.11 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 m -63.55 -31.91 73.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.191 0.52 . . . . 0.0 110.44 176.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.753 HD21 ' HA2' ' A' ' 52' ' ' GLY . 0.3 OUTLIER -85.88 -18.82 31.72 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.897 -177.57 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.77 -37.98 81.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 172.115 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -79.8 -6.84 58.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.667 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.803 ' HB3' HD13 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -95.1 -42.3 8.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.245 -178.137 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.803 HD13 ' HB3' ' A' ' 75' ' ' GLN . 4.2 mp -134.79 -65.52 0.63 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.767 -177.437 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.58 50.27 1.86 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.35 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.702 ' HG ' ' HA ' ' A' ' 51' ' ' LEU . 1.8 mm? -59.66 107.03 0.54 Allowed 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 122.613 0.365 . . . . 0.0 110.797 -178.571 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.451 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.58 17.1 0.16 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.428 -171.941 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -93.13 -29.23 15.87 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.225 0.536 . . . . 0.0 109.659 173.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.425 HD21 ' HB3' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -105.11 -1.7 25.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.664 -173.016 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.483 ' C ' ' HG2' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -123.6 137.61 56.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.292 0.568 . . . . 0.0 111.295 -178.955 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -90.19 174.06 7.82 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 173.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.7 72.28 1.4 Allowed 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 122.039 0.923 . . . . 0.0 110.508 -176.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 98.0 m -72.76 158.57 35.32 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 114.099 -1.409 . . . . 0.0 109.665 175.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -53.43 -35.59 60.62 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -177.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.03 -63.82 1.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.468 0.652 . . . . 0.0 110.327 177.379 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -173.37 -174.56 40.49 Favored Glycine 0 N--CA 1.44 -1.072 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -69.96 132.34 22.81 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.032 1.821 . . . . 0.0 110.846 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 82' ' ' VAL . 0.0 OUTLIER -133.57 -178.53 2.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.934 -169.411 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.43 133.7 50.04 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.256 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.483 ' HG2' ' C ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -71.67 -46.84 57.66 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 -177.074 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -150.68 -70.54 0.18 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.837 -171.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.404 ' HB ' ' HB2' ' A' ' 35' ' ' CYS . 15.7 mt -98.88 120.91 48.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.183 -174.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.6 p -93.51 129.96 43.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.455 ' HB2' ' O ' ' A' ' 106' ' ' VAL . . . -148.81 169.72 19.84 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.398 0.618 . . . . 0.0 111.561 -174.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.16 115.97 31.17 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.217 175.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.518 ' HB3' ' HB1' ' A' ' 33' ' ' ALA . 38.9 t -136.38 126.3 16.08 Favored Pre-proline 0 C--N 1.319 -0.723 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.87 -173.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -67.21 134.38 33.61 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.721 2.281 . . . . 0.0 111.462 178.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.433 ' HA ' ' HG3' ' A' ' 69' ' ' LYS . 1.3 tt0 -67.03 118.23 10.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.106 0.479 . . . . 0.0 109.894 176.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.689 ' O ' ' HA ' ' A' ' 56' ' ' LEU . . . 113.9 -115.93 3.73 Favored Glycine 0 N--CA 1.437 -1.296 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -176.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 66.8 p -98.83 -174.84 2.89 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 123.659 0.27 . . . . 0.0 110.802 -173.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.1 m 74.07 151.67 0.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.686 0.755 . . . . 0.0 112.058 177.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -76.34 159.77 30.22 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.027 -175.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.504 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.4 141.41 46.17 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.893 -179.75 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.567 HG21 ' O ' ' A' ' 106' ' ' VAL . 1.7 m -99.37 135.2 35.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.164 0.507 . . . . 0.0 111.185 -178.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.504 ' HB3' HD22 ' A' ' 59' ' ' LEU . . . -100.52 112.01 24.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.537 176.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.506 HG22 HG23 ' A' ' 25' ' ' THR . 1.8 m -94.45 21.71 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -170.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.1 t0 . . . . . 0 C--N 1.32 -0.692 0 CA-C-O 121.34 0.59 . . . . 0.0 111.108 177.381 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.475 0.805 0 CA-C-O 120.913 0.387 . . . . 0.0 110.94 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.97 98.64 15.69 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -178.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -64.3 132.34 33.45 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.897 2.398 . . . . 0.0 113.199 -175.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 65.19 47.36 2.45 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.243 173.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 p -111.4 100.9 9.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.02 175.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.04 16.93 9.71 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.717 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -93.71 116.46 28.95 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.784 -178.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.01 18.72 20.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.304 0.573 . . . . 0.0 109.997 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -124.51 141.34 52.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.182 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -134.79 49.46 2.22 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.102 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.3 mttm -95.94 -176.0 3.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.231 -178.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.527 ' C ' ' H ' ' A' ' 14' ' ' THR . 7.8 mp -81.39 58.94 3.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.783 -0.189 . . . . 0.0 110.905 -176.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 68.96 -33.4 0.24 Allowed 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.362 0.665 . . . . 0.0 111.536 -177.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.527 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -153.62 -51.36 0.1 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.066 178.146 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.4 m 66.73 -78.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.813 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 52.23 -87.71 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.636 0.585 . . . . 0.0 110.964 -177.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.826 ' HB3' ' HD2' ' A' ' 116' ' ' LYS . . . -60.09 -39.01 84.62 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.63 174.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -69.18 -25.75 64.5 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.044 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.59 -40.28 66.69 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.942 175.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.572 ' NZ ' ' HB2' ' A' ' 118' ' ' GLU . 0.2 OUTLIER -62.83 -35.72 80.84 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 174.127 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.678 ' HG3' ' HB3' ' A' ' 116' ' ' LYS . 1.0 OUTLIER -61.47 -46.9 88.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.211 174.365 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.83 -18.28 64.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.739 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.08 -33.92 13.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.87 178.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.66 -24.4 58.5 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.3 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.71 133.47 52.75 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.801 0.334 . . . . 0.0 110.345 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.33 96.55 4.64 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.104 0.478 . . . . 0.0 111.383 -178.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.4 m -142.04 -177.78 5.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.057 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -117.2 157.34 26.17 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.288 -179.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.36 -48.54 72.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -173.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.37 9.37 61.58 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.812 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 m -139.57 31.4 2.08 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.164 0.507 . . . . 0.0 110.034 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.55 HG23 ' O ' ' A' ' 32' ' ' ILE . 0.1 OUTLIER -90.54 127.93 42.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.383 -179.489 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.88 169.11 21.27 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.085 0.469 . . . . 0.0 111.474 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.8 t -125.72 140.12 52.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.194 172.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -121.91 138.99 54.19 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.474 ' HB2' ' HA ' ' A' ' 81' ' ' LEU . 10.1 t30 -116.16 160.18 20.73 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.77 -179.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.91 126.92 3.22 Favored Pre-proline 0 C--O 1.237 0.443 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.111 172.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.449 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 7.9 Cg_endo -49.69 -38.74 46.74 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.909 3.072 . . . . 0.0 114.198 -171.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.74 -23.96 66.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.758 0.313 . . . . 0.0 111.666 -175.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.427 ' HB2' HD21 ' A' ' 36' ' ' ASN . 51.2 mm-40 -96.49 -41.76 8.42 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 0.0 110.27 -178.369 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.0 m -62.44 -33.65 75.24 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.447 0.641 . . . . 0.0 110.468 175.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.449 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.6 OUTLIER -104.13 16.01 27.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.5 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -52.97 -48.58 67.31 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.212 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.979 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 7.4 t70 -94.53 136.12 35.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.885 175.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -27.44 67.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.103 0.478 . . . . 0.0 110.493 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.01 -26.4 29.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.251 178.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.979 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -60.13 -37.06 78.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.331 178.39 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.32 -34.07 70.19 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.09 179.043 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -94.11 -12.91 55.83 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.104 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.592 ' HB3' HD12 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -77.01 -33.98 57.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.022 0.439 . . . . 0.0 110.664 -178.217 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.43 -30.22 63.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.151 0.5 . . . . 0.0 110.748 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.647 ' HA2' ' HG ' ' A' ' 56' ' ' LEU . . . -91.31 60.44 2.97 Favored Glycine 0 N--CA 1.443 -0.898 0 C-N-CA 121.058 -0.592 . . . . 0.0 112.429 -177.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.457 ' HB2' HD12 ' A' ' 72' ' ' LEU . . . -63.81 -24.86 67.92 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.91 0.386 . . . . 0.0 111.034 -178.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -118.12 22.71 9.59 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.542 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.592 ' O ' HG21 ' A' ' 102' ' ' THR . 21.4 tp 66.27 44.18 2.57 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.162 0.506 . . . . 0.0 110.624 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.647 ' HG ' ' HA2' ' A' ' 52' ' ' GLY . 0.2 OUTLIER -86.07 178.28 7.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.091 -177.648 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -120.06 -176.08 3.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.744 -175.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -100.92 -154.36 26.81 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.295 -174.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.558 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 8.2 tp -66.68 140.38 57.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.831 0.316 . . . . 0.0 110.537 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.65 97.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.723 -178.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 103.16 -10.36 54.88 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.875 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.558 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 23.7 t30 -129.27 93.55 3.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.187 0.518 . . . . 0.0 110.85 -178.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 28.6 m -75.1 93.77 2.81 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.712 176.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 173.4 -58.01 0.14 Allowed Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 178.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.44 84.01 5.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.979 0.418 . . . . 0.0 110.208 177.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.63 155.89 29.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.054 177.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.7 m -122.33 131.53 53.95 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.891 0.377 . . . . 0.0 111.422 -177.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.457 ' HB3' HD21 ' A' ' 81' ' ' LEU . . . -105.13 134.57 48.01 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.879 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.825 ' HD2' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -89.2 167.19 13.29 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.703 -174.066 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.719 ' HA ' HD13 ' A' ' 73' ' ' ILE . . . -58.98 -32.87 70.05 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.413 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -37.85 71.2 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.413 0.625 . . . . 0.0 109.519 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.457 HD12 ' HB2' ' A' ' 53' ' ' ALA . 0.1 OUTLIER -65.8 -31.93 73.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.046 175.719 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.719 HD13 ' HA ' ' A' ' 70' ' ' ALA . 3.9 mt -65.37 -35.67 75.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.318 177.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -84.08 -6.49 59.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.064 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.78 -43.86 8.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.292 0.568 . . . . 0.0 109.9 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.2 mp -132.43 -53.87 0.96 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.562 -176.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.18 51.17 2.28 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.034 -179.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.592 HD12 ' HB3' ' A' ' 50' ' ' LEU . 1.9 mm? -54.04 100.45 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 122.683 0.393 . . . . 0.0 111.432 -177.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.522 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -76.17 1.72 15.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.55 -176.426 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.28 -33.64 67.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.917 0.389 . . . . 0.0 110.946 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.474 ' HA ' ' HB2' ' A' ' 36' ' ' ASN . 0.8 OUTLIER -119.61 4.53 11.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.916 0.389 . . . . 0.0 111.431 -176.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 97.0 t -109.0 138.8 34.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.887 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.897 ' HB2' ' HD3' ' A' ' 92' ' ' LYS . 29.2 t70 -123.43 153.19 40.77 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -118.14 132.35 56.35 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.4 0.619 . . . . 0.0 111.586 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.509 HG21 ' HB2' ' A' ' 87' ' ' GLU . 11.7 t -138.66 174.76 10.19 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.812 -1.085 . . . . 0.0 108.111 174.054 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -68.43 -16.79 64.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.336 0.589 . . . . 0.0 110.716 -178.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.509 ' HB2' HG21 ' A' ' 85' ' ' THR . 40.3 mp0 -77.64 -5.48 50.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.553 176.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 114.69 -174.38 15.39 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.188 -0.529 . . . . 0.0 112.652 177.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -65.85 119.75 6.82 Favored 'Trans proline' 0 N--CA 1.463 -0.274 0 C-N-CA 123.037 2.491 . . . . 0.0 111.18 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.423 HG21 HG23 ' A' ' 85' ' ' THR . 3.0 m -133.25 179.91 3.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.921 0.391 . . . . 0.0 111.528 -172.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.57 146.41 50.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.821 177.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.897 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -86.3 -37.52 18.45 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.327 175.424 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.426 ' O ' ' HA3' ' A' ' 114' ' ' GLY . 6.1 m-80 -150.57 -87.29 0.07 Allowed 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 120.929 0.395 . . . . 0.0 111.601 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 4.7 mt -92.94 131.27 40.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.563 -169.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.523 HG12 ' HA2' ' A' ' 114' ' ' GLY . 2.6 p -100.14 132.1 46.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.511 178.142 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.437 ' HB2' ' HA ' ' A' ' 107' ' ' ALA . . . -154.33 167.12 31.03 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 120.834 0.35 . . . . 0.0 111.449 -177.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.79 126.35 52.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.019 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.825 ' HB3' ' HD2' ' A' ' 69' ' ' LYS . 11.5 t -135.93 134.35 20.42 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.137 -171.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -82.78 142.75 11.49 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 122.898 2.398 . . . . 0.0 113.042 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -81.23 125.44 30.3 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 169.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 134.72 -113.37 1.13 Allowed Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -175.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.592 HG21 ' O ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -146.85 105.49 3.82 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 117.136 0.468 . . . . 0.0 111.874 179.279 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.494 ' HG1' ' C ' ' A' ' 102' ' ' THR . 0.0 OUTLIER 171.73 168.64 0.1 Allowed 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 124.813 1.245 . . . . 0.0 108.764 172.433 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -80.07 171.45 15.07 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.418 -178.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.417 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.04 143.39 43.13 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.272 -178.822 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 3.7 m -95.26 136.54 25.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.712 -177.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.437 ' HA ' ' HB2' ' A' ' 96' ' ' ALA . . . -111.07 124.14 51.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.058 0.456 . . . . 0.0 111.135 -177.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -105.89 11.27 8.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.273 -178.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 110' ' ' ASN . 22.7 t70 -115.53 -81.06 0.61 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.003 179.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.402 ' HB2' ' O ' ' A' ' 109' ' ' ASP . 80.5 m-20 76.67 -53.54 0.58 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.815 0.846 . . . . 0.0 112.307 174.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.17 23.52 7.66 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.848 -175.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -109.68 -14.3 14.42 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.486 -0.864 . . . . 0.0 111.99 178.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . 72.15 22.4 3.65 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.516 0.726 . . . . 0.0 111.511 176.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . 0.523 ' HA2' HG12 ' A' ' 95' ' ' VAL . . . 56.64 54.94 32.61 Favored Glycine 0 C--N 1.331 0.257 0 CA-C-N 116.07 -0.514 . . . . 0.0 113.287 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 4.9 t -83.0 154.04 24.66 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.0 0.428 . . . . 0.0 110.546 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.826 ' HD2' ' HB3' ' A' ' 17' ' ' ALA . 0.0 OUTLIER -130.72 145.47 51.95 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.753 178.081 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -71.51 95.81 1.44 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.393 0.433 . . . . 0.0 110.043 177.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.572 ' HB2' ' NZ ' ' A' ' 20' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.532 -175.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 120.619 0.247 . . . . 0.0 111.024 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.26 117.75 52.54 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-O 120.976 0.417 . . . . 0.0 110.484 179.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -79.23 3.38 7.5 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 122.64 2.227 . . . . 0.0 112.754 -178.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -100.17 -9.9 22.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.381 -178.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.91 -59.37 2.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.874 0.369 . . . . 0.0 111.284 -179.087 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.61 -113.4 0.21 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.348 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 63.7 21.38 12.67 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 123.529 0.518 . . . . 0.0 111.323 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -129.76 30.87 4.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.235 -177.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -101.13 -88.38 0.37 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.718 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -153.22 89.91 1.39 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.931 0.396 . . . . 0.0 110.854 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.2 138.55 33.58 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.24 178.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.427 HD12 ' HD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -94.48 71.5 3.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.307 0.575 . . . . 0.0 109.671 177.305 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -155.66 -46.81 0.08 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.09 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.95 -22.01 60.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.142 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.425 ' HG ' ' HG2' ' A' ' 89' ' ' PRO . 0.0 OUTLIER -78.68 64.07 3.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.289 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.39 -31.88 70.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.225 0.536 . . . . 0.0 110.409 178.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.954 ' HB3' ' HB2' ' A' ' 116' ' ' LYS . . . -65.76 -31.48 72.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.147 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.582 ' HA ' ' NE2' ' A' ' 21' ' ' GLN . 60.2 t80 -66.38 -40.51 89.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.016 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.67 -27.29 50.81 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.144 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.487 ' NZ ' ' HB3' ' A' ' 118' ' ' GLU . 2.9 mttm -55.67 -43.25 76.17 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.575 0.702 . . . . 0.0 109.212 173.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.582 ' NE2' ' HA ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -56.4 -49.0 75.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.346 -1.297 . . . . 0.0 111.147 175.721 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.92 0.61 43.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.137 -173.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -78.1 -15.08 59.2 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.753 0.311 . . . . 0.0 110.662 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.73 -8.75 55.55 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.93 -0.653 . . . . 0.0 111.806 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.31 173.95 6.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.509 0.195 . . . . 0.0 110.553 -179.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.21 97.11 5.44 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.939 0.4 . . . . 0.0 110.949 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -143.25 155.13 44.42 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.238 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -95.17 170.09 9.64 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.628 0.251 . . . . 0.0 110.635 -176.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.8 p -68.02 126.94 28.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 110.126 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.38 -33.63 5.03 Favored Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -176.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.401 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -94.23 25.97 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.218 0.532 . . . . 0.0 110.324 177.563 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -112.68 130.17 66.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.113 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.439 ' HB1' ' HA ' ' A' ' 69' ' ' LYS . . . -149.75 -179.63 7.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.686 0.755 . . . . 0.0 112.524 -172.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.9 t -123.42 132.96 54.11 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.245 175.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.404 ' HB2' HG12 ' A' ' 94' ' ' ILE . 3.9 m -100.36 121.29 41.27 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.792 HD22 ' HB2' ' A' ' 40' ' ' GLU . 14.3 t30 -113.56 148.0 36.94 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.469 -177.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.412 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 45.4 m -54.1 131.13 59.67 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.437 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.444 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 51.9 Cg_exo -53.27 -37.97 81.32 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.489 2.793 . . . . 0.0 114.157 -171.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.64 -18.02 65.15 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.898 0.38 . . . . 0.0 111.915 -175.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.792 ' HB2' HD22 ' A' ' 36' ' ' ASN . 5.0 mm-40 -102.43 -38.86 7.4 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.8 m -62.49 -30.02 70.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.657 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.444 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.7 OUTLIER -104.72 13.3 31.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.045 -179.655 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -61.23 -42.3 98.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.336 0.589 . . . . 0.0 110.556 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.921 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 30.3 t0 -96.09 130.4 43.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.6 m -69.51 -23.78 63.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.091 0.472 . . . . 0.0 110.315 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -33.39 62.36 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.199 174.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.921 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -64.48 -32.39 74.0 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.416 178.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.2 t -61.65 -22.04 64.93 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.138 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -106.5 -9.87 30.28 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.439 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.679 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 1.1 mp -82.9 -23.33 33.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.921 0.391 . . . . 0.0 110.574 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.34 -29.03 53.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.094 0.474 . . . . 0.0 110.33 176.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -98.43 83.37 0.65 Allowed Glycine 0 N--CA 1.441 -1.015 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.004 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.556 ' HB2' HD11 ' A' ' 72' ' ' LEU . . . -77.41 -6.64 54.12 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.397 0.618 . . . . 0.0 109.944 177.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.3 -126.14 1.27 Allowed Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.023 176.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.466 ' O ' HG23 ' A' ' 102' ' ' THR . 0.0 OUTLIER -107.66 55.35 0.65 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.291 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.939 HD11 ' HZ2' ' A' ' 69' ' ' LYS . 3.3 mt -79.92 169.73 17.48 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.786 -172.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.464 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 19.4 t-20 -131.59 -179.45 5.39 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.94 175.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.549 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -99.81 -133.24 8.03 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.847 -175.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.765 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 7.9 tp -80.23 152.64 29.0 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.05 89.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.188 0.518 . . . . 0.0 111.152 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.27 -2.27 57.7 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.7 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.765 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 47.4 t30 -124.86 102.28 7.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.018 0.437 . . . . 0.0 110.877 -178.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.42 73.98 6.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.15 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.58 -55.73 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.909 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.64 79.47 4.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.03 0.443 . . . . 0.0 110.823 178.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.549 ' HA ' ' HA2' ' A' ' 58' ' ' GLY . . . -74.72 124.89 27.58 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 173.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.8 m -110.62 128.79 55.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.11 0.481 . . . . 0.0 110.271 -175.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.525 ' H ' HD11 ' A' ' 81' ' ' LEU . . . -106.21 144.65 32.61 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.804 -174.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.939 ' HZ2' HD11 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -103.51 -174.92 2.66 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.38 -175.424 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.71 -28.57 63.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.565 -178.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.425 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -63.95 -42.31 97.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.468 0.651 . . . . 0.0 110.233 177.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.556 HD11 ' HB2' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -77.26 -35.89 54.87 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.823 -179.95 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.454 HG12 HG22 ' A' ' 82' ' ' VAL . 3.5 mt -65.54 -37.25 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.358 -179.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -72.91 -41.32 64.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.929 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.425 ' HB2' ' O ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -76.4 -53.19 8.51 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.328 -173.468 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.498 ' HA ' HD11 ' A' ' 76' ' ' LEU . 0.5 OUTLIER -106.19 -44.52 4.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.25 -172.839 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.94 50.24 7.07 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.194 -1.003 . . . . 0.0 112.504 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.486 HD13 ' HB2' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -62.59 106.01 0.72 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 122.332 0.253 . . . . 0.0 111.362 -179.709 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.01 -6.53 39.61 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.891 -177.228 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.776 ' HB3' HD13 ' A' ' 47' ' ' LEU . . . -86.74 -13.75 44.36 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.906 0.384 . . . . 0.0 110.387 177.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.525 HD11 ' H ' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -108.62 -33.96 6.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.083 -176.331 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.454 HG22 HG12 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -108.46 137.32 40.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.69 179.805 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.403 ' O ' ' HA ' ' A' ' 89' ' ' PRO . 11.3 t70 -98.18 176.01 5.88 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 175.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.91 112.19 7.32 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.946 0.403 . . . . 0.0 111.285 -175.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.798 ' HG1' HG21 ' A' ' 90' ' ' VAL . 1.2 p -118.82 -167.64 1.41 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.802 177.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.465 ' OE1' ' HB ' ' A' ' 85' ' ' THR . 0.0 OUTLIER -66.16 -33.27 75.39 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 177.588 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -80.02 4.8 15.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.437 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 103.8 -155.48 17.75 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.764 173.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.425 ' HG2' ' HG ' ' A' ' 15' ' ' SER . 73.2 Cg_endo -73.4 126.13 10.73 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.876 2.384 . . . . 0.0 111.27 177.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.798 HG21 ' HG1' ' A' ' 85' ' ' THR . 0.0 OUTLIER -133.12 175.07 12.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.29 -173.137 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.07 116.96 9.29 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.997 178.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.5 tttp -76.19 -25.11 54.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.279 0.562 . . . . 0.0 110.433 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -133.02 -106.21 0.25 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.861 -176.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.455 HG23 ' HA2' ' A' ' 112' ' ' GLY . 0.6 OUTLIER -113.69 149.11 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.831 0.348 . . . . 0.0 111.042 -174.18 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.422 ' H ' HG21 ' A' ' 95' ' ' VAL . 1.5 t -80.87 144.75 10.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.556 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -154.2 170.2 21.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.03 0.443 . . . . 0.0 111.763 -177.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.6 m -124.33 108.42 12.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.0 177.244 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.539 ' HB2' ' CD ' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -127.85 141.71 42.0 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.243 -174.017 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -87.81 154.57 7.38 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.165 2.576 . . . . 0.0 113.099 -179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.461 ' CD ' ' HZ1' ' A' ' 69' ' ' LYS . 3.6 tp10 -98.26 117.62 33.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.401 173.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.455 ' C ' ' HG1' ' A' ' 102' ' ' THR . . . 145.06 -67.78 0.42 Allowed Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.008 177.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.466 HG23 ' O ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -157.4 177.33 11.55 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.693 HG22 ' H ' ' A' ' 104' ' ' ASN . 1.4 m 69.79 167.59 0.29 Allowed 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.603 0.716 . . . . 0.0 111.919 177.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.693 ' H ' HG22 ' A' ' 103' ' ' THR . 4.5 p30 -89.88 -179.29 5.69 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.542 -171.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.537 ' HB2' ' HB3' ' A' ' 98' ' ' CYS . 7.2 t -112.79 148.69 34.29 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.745 -175.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.532 HG21 ' O ' ' A' ' 106' ' ' VAL . 2.0 m -104.26 138.34 29.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.953 0.406 . . . . 0.0 110.204 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.86 117.79 27.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.817 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -121.49 26.41 3.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.953 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -61.23 -53.05 61.82 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.006 176.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 70.99 10.78 6.98 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 114.881 -1.054 . . . . 0.0 113.145 170.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -122.48 -42.79 2.32 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.1 0.476 . . . . 0.0 110.761 177.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . 0.455 ' HA2' HG23 ' A' ' 94' ' ' ILE . . . 110.0 4.53 29.45 Favored Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 111.282 -0.727 . . . . 0.0 111.282 -178.148 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -163.79 117.35 1.49 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.461 -0.37 . . . . 0.0 110.013 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . 0.435 ' C ' ' HG1' ' A' ' 115' ' ' THR . . . -59.58 -48.27 86.84 Favored Glycine 0 N--CA 1.453 -0.169 0 C-N-CA 121.27 -0.491 . . . . 0.0 112.891 -179.075 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.435 ' HG1' ' C ' ' A' ' 114' ' ' GLY . 0.2 OUTLIER 62.96 98.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.273 0.629 . . . . 0.0 111.384 -179.193 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.954 ' HB2' ' HB3' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -72.01 -23.16 61.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.695 -179.848 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -72.57 119.09 16.31 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.433 176.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.487 ' HB3' ' NZ ' ' A' ' 20' ' ' LYS . 2.9 tm-20 . . . . . 0 C--O 1.251 1.15 0 CA-C-O 117.774 -1.107 . . . . 0.0 108.987 -177.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.555 ' H3 ' ' CG ' ' A' ' 74' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 120.789 0.328 . . . . 0.0 110.941 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.24 141.6 34.92 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.151 -0.315 . . . . 0.0 110.151 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.73 71.32 3.32 Favored 'Trans proline' 0 C--O 1.233 0.27 0 C-N-CA 122.645 2.23 . . . . 0.0 112.748 -179.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.92 -32.97 72.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.196 176.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.08 150.78 35.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.266 175.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -82.19 53.77 2.35 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.236 0.541 . . . . 0.0 110.849 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.21 79.85 1.27 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.29 0.567 . . . . 0.0 110.912 -178.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.45 -3.84 56.2 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.512 0.672 . . . . 0.0 109.885 178.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.1 p-10 -98.31 -35.46 10.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.971 -1.013 . . . . 0.0 111.218 -175.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -117.6 108.57 15.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.831 0.348 . . . . 0.0 111.247 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.84 157.36 46.2 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.354 178.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.697 ' HG ' ' HB1' ' A' ' 70' ' ' ALA . 0.2 OUTLIER -88.02 -9.64 52.78 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.97 174.746 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.04 -8.7 59.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.608 -177.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.48 6.82 8.94 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.929 0.395 . . . . 0.0 111.559 -177.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 m -61.97 -50.6 71.46 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.422 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 60.72 -73.44 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.743 0.652 . . . . 0.0 112.071 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.5 -28.66 69.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.566 -178.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -62.9 -38.61 91.63 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.183 0.516 . . . . 0.0 110.257 176.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -71.58 -22.06 61.78 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.837 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.462 ' HA ' ' HG2' ' A' ' 23' ' ' GLU . 16.9 mtpp -75.65 -22.25 56.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.723 0.773 . . . . 0.0 109.052 178.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.461 ' NE2' ' HA ' ' A' ' 116' ' ' LYS . 0.5 OUTLIER -82.3 -41.95 19.45 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.522 173.621 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.69 -17.34 60.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.988 -1.005 . . . . 0.0 112.266 -175.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.462 ' HG2' ' HA ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -77.17 -9.2 58.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.675 0.274 . . . . 0.0 111.039 179.228 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.72 -20.04 58.8 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.669 -0.776 . . . . 0.0 112.216 177.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -125.48 123.29 38.88 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.15 97.67 1.23 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.268 0.556 . . . . 0.0 111.945 -176.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.3 m -140.85 152.52 45.18 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 173.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -84.2 153.93 23.36 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -173.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.05 -40.99 84.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -176.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.0 -8.86 86.95 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.528 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.1 10.06 12.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.033 0.444 . . . . 0.0 110.803 -178.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.467 ' O ' HG21 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -90.24 137.94 20.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.445 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . . . -149.64 -178.69 6.58 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -170.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.55 ' HB3' HD13 ' A' ' 81' ' ' LEU . 4.4 t -144.43 142.15 30.11 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.278 173.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.809 ' HB2' ' HB ' ' A' ' 94' ' ' ILE . 78.6 m -113.86 158.32 21.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.839 0.352 . . . . 0.0 110.401 179.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -145.26 150.72 37.17 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -42.96 139.45 2.15 Favored Pre-proline 0 C--O 1.235 0.33 0 O-C-N 123.733 0.646 . . . . 0.0 112.436 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.508 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 70.4 Cg_exo -51.22 -54.6 5.13 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.596 2.864 . . . . 0.0 113.881 -172.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.9 -7.7 23.9 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -172.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -100.56 -51.36 3.63 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.771 0.32 . . . . 0.0 110.718 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.3 m -68.35 -33.3 74.03 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.388 0.613 . . . . 0.0 110.606 178.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.508 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.3 m-80 -101.34 14.38 32.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.654 -178.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -61.31 -41.91 97.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.379 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.825 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 35.5 t70 -94.96 140.27 30.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.558 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -42.05 97.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.183 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.35 -33.55 73.26 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.862 0.363 . . . . 0.0 110.38 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.825 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -59.9 -36.77 77.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.772 177.415 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.34 -23.28 66.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.933 0.396 . . . . 0.0 110.981 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -98.5 -7.02 56.23 Favored Glycine 0 C--N 1.329 0.189 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.496 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.604 HD11 HD22 ' A' ' 76' ' ' LEU . 2.6 tt -82.3 -31.25 30.07 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.009 0.433 . . . . 0.0 110.43 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.521 HD22 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -75.83 -16.23 60.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.881 179.003 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.56 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -113.81 77.99 0.25 Allowed Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 120.957 -0.64 . . . . 0.0 112.225 -176.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.515 ' HB1' HD11 ' A' ' 72' ' ' LEU . . . -78.95 54.06 1.51 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.243 0.544 . . . . 0.0 110.412 177.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.01 -117.74 1.04 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 -177.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.9 mt -117.6 49.14 1.25 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.252 0.549 . . . . 0.0 109.778 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.56 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 1.0 OUTLIER -82.72 175.84 9.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.275 -171.362 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.552 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 6.2 t-20 -135.86 -178.79 5.29 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.299 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -111.79 -132.12 5.87 Favored Glycine 0 C--N 1.315 -0.606 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 -177.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.451 HD23 ' HA ' ' A' ' 59' ' ' LEU . 0.1 OUTLIER -66.42 149.8 49.86 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 175.684 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.412 ' HG ' ' C ' ' A' ' 105' ' ' CYS . 74.4 m -65.43 89.72 0.1 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.139 0.495 . . . . 0.0 110.957 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.1 -37.24 3.85 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.604 178.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -89.69 98.62 11.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.912 0.387 . . . . 0.0 111.332 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.69 72.16 2.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.152 179.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -169.76 -51.37 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 111.188 -0.765 . . . . 0.0 111.188 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.02 77.73 6.7 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.043 0.449 . . . . 0.0 110.533 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.51 142.45 40.88 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.76 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 4.6 m -123.11 148.41 45.7 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.374 -0.531 . . . . 0.0 111.081 -174.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.51 ' CB ' HD13 ' A' ' 78' ' ' LEU . . . -107.59 139.26 42.4 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.27 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.743 ' HE3' HD21 ' A' ' 72' ' ' LEU . 0.0 OUTLIER -94.3 167.38 11.57 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.402 179.763 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.697 ' HB1' ' HG ' ' A' ' 12' ' ' LEU . . . -59.73 -30.69 69.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.058 0.456 . . . . 0.0 110.083 176.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -27.02 68.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.885 176.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.743 HD21 ' HE3' ' A' ' 69' ' ' LYS . 1.1 tp -91.14 -24.9 19.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.893 0.378 . . . . 0.0 110.733 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 76.2 mt -72.75 -29.17 29.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 172.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.555 ' CG ' ' H3 ' ' A' ' 1' ' ' SER . 0.0 OUTLIER -80.11 -12.82 59.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.006 172.845 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.578 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 1.1 tp-100 -93.97 -45.31 7.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.342 -178.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.604 HD22 HD11 ' A' ' 50' ' ' LEU . 2.0 mp -120.28 -41.94 2.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.688 -174.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.61 50.03 3.25 Favored Glycine 0 CA--C 1.515 0.087 0 C-N-CA 120.105 -1.045 . . . . 0.0 112.13 -178.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.51 HD13 ' CB ' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -81.56 164.19 22.1 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.699 0.285 . . . . 0.0 111.64 -175.519 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.61 ' HA ' HG23 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -122.56 -0.83 9.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.977 -177.892 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.56 -35.46 68.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -173.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.55 HD13 ' HB3' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -116.67 27.07 9.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.761 0.315 . . . . 0.0 111.118 -176.734 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.61 HG23 ' HA ' ' A' ' 79' ' ' LEU . 2.0 t -119.21 137.12 54.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.466 178.278 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.911 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 2.6 t70 -124.13 177.4 5.83 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.987 0.422 . . . . 0.0 111.602 -176.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -56.82 133.4 54.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.853 -175.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.594 ' HB ' HG21 ' A' ' 90' ' ' VAL . 5.7 t -159.32 150.28 19.78 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.106 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -108.53 -19.57 13.4 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.951 0.405 . . . . 0.0 110.474 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -90.36 -46.44 8.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.463 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 174.14 149.3 6.97 Favored Glycine 0 N--CA 1.444 -0.798 0 N-CA-C 111.219 -0.752 . . . . 0.0 111.219 -177.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.55 ' HA ' HG23 ' A' ' 85' ' ' THR . 88.8 Cg_exo -45.61 126.85 9.17 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 123.812 3.008 . . . . 0.0 113.393 -173.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.594 HG21 ' HB ' ' A' ' 85' ' ' THR . 8.7 m -127.43 -179.81 3.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.409 -176.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.76 135.06 52.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.069 -177.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.911 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.5 tttp -85.77 -28.28 24.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.489 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.42 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -148.21 -92.2 0.08 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -169.696 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.809 ' HB ' ' HB2' ' A' ' 35' ' ' CYS . 8.7 mt -101.16 117.15 46.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.091 -168.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.5 t -73.95 125.99 33.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.231 -0.44 . . . . 0.0 109.971 176.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -154.54 176.6 12.19 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.001 -176.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 53.6 m -128.13 127.57 43.27 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.218 177.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.76 ' SG ' ' HB2' ' A' ' 67' ' ' CYS . 19.2 m -120.72 137.37 26.3 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.394 -174.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -86.33 155.16 9.41 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 122.428 2.086 . . . . 0.0 111.475 170.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.69 156.04 17.55 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 173.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 97.49 -71.55 0.7 Allowed Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.368 -178.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -150.55 172.03 16.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.511 0.196 . . . . 0.0 111.528 -176.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 74.48 168.04 0.29 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.644 0.778 . . . . 0.0 113.052 172.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.552 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.4 OUTLIER -95.35 178.37 5.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.79 -1.095 . . . . 0.0 112.145 -170.239 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.412 ' C ' ' HG ' ' A' ' 60' ' ' SER . 4.4 m -112.89 142.65 45.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.875 -176.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -90.76 148.99 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 174.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -107.04 140.98 38.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.595 0.236 . . . . 0.0 111.098 -176.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -129.81 20.45 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.826 0.346 . . . . 0.0 111.266 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.89 -54.09 12.73 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 176.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 64.66 -79.56 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.352 179.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -166.84 54.38 0.08 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.555 -179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -172.95 84.0 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.452 -0.88 . . . . 0.0 112.905 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -147.11 90.03 1.85 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.867 0.365 . . . . 0.0 110.482 178.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . 0.478 ' C ' ' HG1' ' A' ' 115' ' ' THR . . . -76.42 -69.19 1.42 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.269 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.478 ' HG1' ' C ' ' A' ' 114' ' ' GLY . 0.0 OUTLIER -166.48 -45.02 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.806 0.336 . . . . 0.0 110.785 177.837 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.461 ' HA ' ' NE2' ' A' ' 21' ' ' GLN . 1.7 pttm -177.89 -32.49 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.109 -176.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -94.16 84.55 4.47 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.775 177.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 . . . . . 0 C--O 1.251 1.152 0 CA-C-O 118.539 -0.744 . . . . 0.0 110.553 -175.721 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.476 0.855 0 CA-C-O 120.566 0.222 . . . . 0.0 110.631 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.05 126.87 82.75 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.992 -178.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -66.71 -11.85 33.56 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 123.119 2.546 . . . . 0.0 112.632 177.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 54.99 38.3 30.29 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.051 176.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -147.45 -90.89 0.09 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.248 177.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -137.31 110.03 7.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.241 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -108.28 -3.54 18.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.954 0.407 . . . . 0.0 111.055 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.503 ' HZ1' ' CG ' ' A' ' 74' ' ' ASP . 0.9 OUTLIER -155.05 110.48 3.08 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.396 0.617 . . . . 0.0 111.373 -177.776 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -108.22 170.88 7.73 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.259 -0.882 . . . . 0.0 108.932 171.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.71 69.9 0.67 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.441 0.638 . . . . 0.0 111.569 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.5 mmtt -138.01 155.04 49.24 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 176.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.751 ' HB2' ' HG ' ' A' ' 15' ' ' SER . 5.0 mp -76.55 60.99 1.71 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.589 0.233 . . . . 0.0 110.564 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.53 38.73 30.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.249 -179.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 58.76 50.14 9.14 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.68 -174.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.751 ' HG ' ' HB2' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -51.99 -52.54 49.84 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.597 -176.408 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.3 -56.64 0.44 Allowed 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.575 0.75 . . . . 0.0 111.599 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.9 -35.71 81.39 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.017 0.437 . . . . 0.0 110.919 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -68.87 -25.12 64.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.479 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.51 -24.24 60.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.458 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -67.98 -29.8 68.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 176.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.539 ' OE1' ' HA ' ' A' ' 116' ' ' LYS . 0.0 OUTLIER -75.29 -27.66 59.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.406 -1.27 . . . . 0.0 110.519 177.274 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.12 -18.83 62.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.682 -176.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.06 -8.11 13.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.029 0.442 . . . . 0.0 110.563 175.046 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -83.44 -24.94 49.22 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.496 -0.859 . . . . 0.0 111.116 175.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.38 135.01 48.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -74.73 96.91 3.12 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.017 0.437 . . . . 0.0 111.592 -176.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 60.9 m -145.47 136.05 24.27 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 175.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -69.14 144.41 53.86 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.471 -0.196 . . . . 0.0 110.471 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 t -62.95 -36.67 76.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.691 0.282 . . . . 0.0 111.255 -178.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.54 -7.98 88.0 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.999 -0.619 . . . . 0.0 112.289 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.21 38.72 3.13 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.948 0.404 . . . . 0.0 110.133 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.5 tt -99.06 134.43 38.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.533 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -147.97 171.54 15.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.127 0.489 . . . . 0.0 111.585 -172.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.47 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 2.0 t -120.28 145.65 46.87 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.076 172.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -128.68 157.61 40.87 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -176.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.453 ' HB2' ' CD1' ' A' ' 81' ' ' LEU . 10.6 t-20 -151.26 160.42 43.82 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 -177.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.52 146.79 23.01 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.011 176.103 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.595 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 10.7 Cg_endo -54.08 -38.13 87.09 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.154 2.569 . . . . 0.0 112.976 -176.198 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.5 -13.97 62.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.966 0.413 . . . . 0.0 111.717 -175.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -103.39 -50.11 3.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.638 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 22.7 m -59.76 -36.83 77.46 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.795 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.595 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.9 m-80 -104.8 16.93 25.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.029 -176.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -56.03 -27.68 54.2 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.725 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.995 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 12.2 t70 -116.17 133.28 56.19 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 172.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 17.2 m -66.88 -21.21 66.01 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -176.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.1 tp -91.09 -25.3 19.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.245 0.545 . . . . 0.0 110.12 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.995 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 3.1 tp -61.57 -37.63 84.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.47 -177.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.696 ' HA ' HD23 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -64.64 -20.14 66.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.91 -177.084 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -95.96 -9.73 56.95 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.045 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.562 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 2.0 mp -85.82 -26.07 25.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.825 0.345 . . . . 0.0 111.154 -177.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.711 ' HA ' HD21 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -80.03 -11.11 59.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.939 0.4 . . . . 0.0 111.744 -175.646 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.627 ' HA3' ' CB ' ' A' ' 56' ' ' LEU . . . -128.05 91.28 0.34 Allowed Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.808 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.517 ' HB2' HD13 ' A' ' 72' ' ' LEU . . . -77.91 74.68 4.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.258 0.551 . . . . 0.0 110.648 -178.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 159.49 -69.53 0.25 Allowed Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.136 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.2 tp -136.54 -40.72 0.63 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.627 ' CB ' ' HA3' ' A' ' 52' ' ' GLY . 0.1 OUTLIER 69.13 134.34 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 122.435 1.112 . . . . 0.0 112.672 178.603 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.557 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 8.8 t-20 -141.44 -178.8 5.79 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 114.202 -1.363 . . . . 0.0 107.9 171.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.669 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -114.97 -145.44 8.71 Favored Glycine 0 C--N 1.312 -0.768 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.62 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.438 ' HB3' ' HB2' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -65.2 156.28 32.33 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.469 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.7 m -52.28 101.94 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.099 0.476 . . . . 0.0 111.726 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 74.67 18.63 80.04 Favored Glycine 0 C--N 1.338 0.663 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.529 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.438 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 4.1 t30 -123.29 94.52 4.28 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.866 0.365 . . . . 0.0 110.795 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.06 99.67 7.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.065 0.459 . . . . 0.0 111.051 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 155.7 -55.37 0.41 Allowed Glycine 0 CA--C 1.508 -0.348 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 177.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.78 84.15 6.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.954 0.407 . . . . 0.0 109.999 175.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.669 ' HA ' ' HA2' ' A' ' 58' ' ' GLY . . . -90.54 150.81 21.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.936 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 m -124.26 136.34 54.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.972 0.415 . . . . 0.0 111.195 -174.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.725 ' HB3' HD21 ' A' ' 81' ' ' LEU . . . -105.63 139.23 40.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.95 178.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -95.54 168.24 10.81 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.732 -173.885 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.49 -33.32 73.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.047 0.451 . . . . 0.0 111.026 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -31.01 71.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.331 0.586 . . . . 0.0 110.173 177.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.517 HD13 ' HB2' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -79.73 -21.65 44.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.686 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.94 -41.5 89.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.368 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.503 ' CG ' ' HZ1' ' A' ' 8' ' ' LYS . 7.5 t0 -90.22 -0.44 57.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.461 . . . . 0.0 110.746 179.025 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.79 -52.95 4.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.535 178.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.562 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 1.1 mm? -118.67 -46.22 2.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.131 -177.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 101.97 52.54 1.01 Allowed Glycine 0 CA--C 1.519 0.315 0 C-N-CA 119.724 -1.227 . . . . 0.0 113.388 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.711 HD21 ' HA ' ' A' ' 51' ' ' LEU . 3.9 mm? -64.48 92.34 0.09 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.989 0.424 . . . . 0.0 111.736 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.8 -11.65 60.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.686 -178.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.593 ' HB1' HD21 ' A' ' 47' ' ' LEU . . . -84.24 -15.46 46.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.174 0.511 . . . . 0.0 110.621 178.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.725 HD21 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -108.37 -16.35 14.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.622 -176.258 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.33 137.85 46.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.187 0.518 . . . . 0.0 110.976 -178.037 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.618 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 3.2 t70 -113.85 176.91 4.83 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 176.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -135.19 124.7 24.99 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -171.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.478 HG21 ' HD3' ' A' ' 116' ' ' LYS . 0.6 OUTLIER -117.15 -169.34 1.63 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.988 -1.006 . . . . 0.0 108.962 171.578 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.02 -29.15 61.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.849 0.357 . . . . 0.0 110.778 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.542 ' HB3' ' O ' ' A' ' 15' ' ' SER . 35.3 mp0 -76.6 -14.52 59.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.621 -178.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 135.51 -165.52 24.73 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 119.964 -1.113 . . . . 0.0 112.728 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -74.49 125.6 9.71 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.88 2.386 . . . . 0.0 111.802 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.502 ' H ' HG23 ' A' ' 90' ' ' VAL . 0.7 OUTLIER -124.15 -177.96 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.079 -176.699 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.613 ' O ' ' HA ' ' A' ' 115' ' ' THR . 0.1 OUTLIER -70.28 129.93 40.65 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 178.495 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.618 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 11.8 tttp -79.74 -27.69 40.54 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.639 -176.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -155.02 -90.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -172.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 5.2 mt -95.63 138.66 20.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.002 -171.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.6 t -101.67 123.09 54.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.586 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.15 157.92 43.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.909 -177.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.36 124.26 49.25 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 177.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.448 ' CA ' ' HB3' ' A' ' 105' ' ' CYS . 8.3 t -135.45 133.03 20.12 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.188 -171.172 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.406 ' O ' ' HD2' ' A' ' 69' ' ' LYS . 36.9 Cg_endo -65.84 171.77 9.35 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.755 2.304 . . . . 0.0 111.683 174.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.63 -82.49 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -171.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -128.02 0.76 6.67 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.064 -1.065 . . . . 0.0 113.413 -174.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.03 142.32 51.57 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.682 0.241 . . . . 0.0 111.511 -175.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 6.3 m 73.59 157.32 0.19 Allowed 'General case' 0 CA--C 1.532 0.286 0 O-C-N 123.882 0.739 . . . . 0.0 112.304 175.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.557 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.7 OUTLIER -73.11 168.9 18.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.762 -175.374 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.448 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -113.22 141.82 46.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.027 -179.403 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -83.3 145.99 7.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.065 174.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.94 115.69 23.02 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.458 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.447 ' H ' HG22 ' A' ' 108' ' ' VAL . 0.1 OUTLIER -85.89 -8.63 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-O 121.837 0.827 . . . . 0.0 110.071 177.563 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -117.79 135.9 53.76 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 114.315 -1.311 . . . . 0.0 108.512 176.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -121.12 61.9 0.9 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.177 0.513 . . . . 0.0 109.877 -177.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 67.31 47.57 1.28 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.171 178.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -139.36 10.8 3.25 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.626 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.431 ' HB2' ' H ' ' A' ' 114' ' ' GLY . . . -94.82 -154.91 0.44 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 122.758 -0.26 . . . . 0.0 110.836 178.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . 0.431 ' H ' ' HB2' ' A' ' 113' ' ' ALA . . . -158.56 -174.72 28.64 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 121.201 -0.523 . . . . 0.0 112.003 -177.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.613 ' HA ' ' O ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -59.52 -63.53 1.27 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.167 0.508 . . . . 0.0 111.026 -178.709 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.539 ' HA ' ' OE1' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -152.7 146.9 25.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.343 178.691 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -80.44 127.58 32.58 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.7 177.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 C--O 1.248 1.019 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.855 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.477 0.913 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -102.23 115.21 64.9 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.554 179.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.408 ' C ' ' H ' ' A' ' 5' ' ' SER . 52.8 Cg_endo -68.81 156.71 64.56 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.996 2.464 . . . . 0.0 112.416 -179.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 74.36 -20.19 0.33 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.588 0.755 . . . . 0.0 112.176 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.408 ' H ' ' C ' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -89.31 20.15 3.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.838 -0.164 . . . . 0.0 111.117 178.422 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 53.54 79.09 0.13 Allowed 'General case' 0 C--O 1.234 0.277 0 O-C-N 123.581 0.55 . . . . 0.0 111.64 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.91 73.22 7.45 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.096 -177.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.3 94.15 7.29 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.952 177.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -85.22 -30.29 23.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.718 -175.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.52 ' HB2' HG22 ' A' ' 73' ' ' ILE . . . -82.05 164.94 21.05 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.2 0.524 . . . . 0.0 112.103 -172.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.6 mttp -130.8 -69.66 0.64 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.523 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.96 -39.79 0.42 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.772 0.829 . . . . 0.0 111.612 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.3 -34.86 78.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.709 0.29 . . . . 0.0 111.39 179.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.71 -20.15 47.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.81 0.338 . . . . 0.0 111.641 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.674 ' HA ' ' O ' ' A' ' 87' ' ' GLU . 0.3 OUTLIER -76.19 68.15 2.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.211 0.529 . . . . 0.0 111.317 179.295 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.75 -19.9 66.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.851 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.668 ' HB1' ' HB3' ' A' ' 116' ' ' LYS . . . -82.04 -26.89 33.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.503 177.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.539 ' O ' ' HB2' ' A' ' 21' ' ' GLN . 41.2 t80 -82.73 -41.55 19.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.758 -178.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.76 -18.91 61.66 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.7 mttp -67.33 -18.01 64.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.014 0.435 . . . . 0.0 110.533 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -63.69 -28.1 69.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.562 177.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.05 -18.56 62.56 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.406 -178.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -98.35 -41.53 7.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.487 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -66.41 -30.33 76.39 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.679 177.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.62 123.02 24.32 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 176.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.79 97.64 1.82 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.02 0.438 . . . . 0.0 111.464 -176.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 79.8 m -139.51 -178.43 5.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.653 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.674 ' H ' ' HB2' ' A' ' 31' ' ' SER . 30.0 t-20 -122.03 176.61 5.71 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 -176.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.625 HG22 ' H ' ' A' ' 30' ' ' GLY . 2.5 m -52.76 -53.49 20.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -178.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.625 ' H ' HG22 ' A' ' 29' ' ' VAL . . . -89.41 20.62 33.21 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.961 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.674 ' HB2' ' H ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -123.61 -12.2 7.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.849 0.357 . . . . 0.0 110.839 177.044 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.411 ' O ' HG21 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -82.22 127.26 39.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 175.684 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.72 153.99 38.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.152 0.501 . . . . 0.0 111.462 -174.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 11.5 t -122.7 143.06 50.04 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.628 176.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -127.54 163.83 23.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.605 0.716 . . . . 0.0 110.985 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.458 ' HB2' ' HA ' ' A' ' 81' ' ' LEU . 20.2 t-20 -136.14 160.82 37.51 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.19 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -45.8 137.07 5.99 Favored Pre-proline 0 C--N 1.329 -0.292 0 O-C-N 123.588 0.555 . . . . 0.0 110.457 177.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.491 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 79.7 Cg_exo -48.54 -36.84 32.58 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 123.254 2.636 . . . . 0.0 113.351 -175.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.02 -7.82 50.99 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -177.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -109.18 -41.78 4.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.127 0.489 . . . . 0.0 109.86 178.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 29.0 m -65.45 -37.05 85.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.671 175.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.491 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.3 m-80 -100.27 15.31 28.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.707 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -65.11 -32.75 74.61 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.474 -176.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.933 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.6 t70 -104.8 146.6 28.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.636 178.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.86 -36.94 75.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.002 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.3 tp -86.47 -20.89 27.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.134 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.933 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -53.73 -47.54 70.49 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.109 0.481 . . . . 0.0 111.203 179.047 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.59 -18.24 65.26 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.22 -178.304 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -93.98 -29.13 10.04 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.737 176.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.9 mt -74.11 -24.53 59.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 176.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -51.8 66.02 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.691 173.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -87.02 74.23 2.35 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.842 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.582 ' HB2' HD23 ' A' ' 72' ' ' LEU . . . -100.9 32.92 2.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.593 0.711 . . . . 0.0 109.334 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 160.73 -111.88 0.5 Allowed Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.51 -174.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.605 HD12 ' HA2' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -117.15 72.33 0.83 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.364 0.602 . . . . 0.0 110.392 176.896 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.944 ' HG ' ' HZ2' ' A' ' 69' ' ' LYS . 1.5 mp -123.44 134.1 53.98 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.253 178.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -128.42 -177.34 4.13 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.297 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.72 -162.83 35.06 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.617 -0.802 . . . . 0.0 113.073 -173.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.507 HD12 ' H ' ' A' ' 60' ' ' SER . 0.4 OUTLIER -65.35 158.2 27.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.508 0.194 . . . . 0.0 110.494 -179.679 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.977 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -61.07 88.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.464 0.65 . . . . 0.0 112.283 -177.638 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.03 4.1 78.76 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.454 -0.794 . . . . 0.0 113.11 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.4 t30 -117.66 134.6 54.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 117.123 0.461 . . . . 0.0 111.422 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.0 125.99 47.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.407 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.11 -49.37 0.93 Allowed Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.856 -0.687 . . . . 0.0 111.752 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.401 ' HB2' HD21 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -82.56 115.5 21.57 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 175.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -127.77 147.34 50.41 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.265 179.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.9 m -121.08 135.63 55.15 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.909 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.723 ' HB1' HD12 ' A' ' 81' ' ' LEU . . . -105.82 152.45 23.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 176.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.944 ' HZ2' ' HG ' ' A' ' 56' ' ' LEU . 0.0 OUTLIER -111.62 -177.2 3.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.385 -176.956 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.3 -24.5 67.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.073 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.413 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -66.77 -31.02 71.38 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.417 0.627 . . . . 0.0 110.027 178.773 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.771 HD22 HD11 ' A' ' 56' ' ' LEU . 0.1 OUTLIER -90.43 -33.72 15.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.709 179.632 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.52 HG22 ' HB2' ' A' ' 10' ' ' ALA . 6.1 mt -65.87 -39.45 84.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.597 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.468 ' HA ' ' HB3' ' A' ' 10' ' ' ALA . 1.5 t0 -84.48 -2.97 58.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.899 0.381 . . . . 0.0 110.841 178.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -94.75 -53.31 3.91 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.052 0.453 . . . . 0.0 110.823 178.38 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 76' ' ' LEU . 0.4 OUTLIER -126.28 -28.57 3.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.804 -175.339 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.04 50.69 4.49 Favored Glycine 0 C--O 1.228 -0.274 0 C-N-CA 120.343 -0.932 . . . . 0.0 111.929 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.484 ' HA ' HD22 ' A' ' 78' ' ' LEU . 2.6 mt -59.19 96.15 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.766 0.426 . . . . 0.0 111.944 -176.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.509 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -79.17 6.26 10.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.414 -177.15 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.97 -26.47 64.11 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.255 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.723 HD12 ' HB1' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -129.9 2.1 4.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.714 -176.292 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 39.0 t -111.69 138.25 41.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.12 0.486 . . . . 0.0 110.97 -175.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.408 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 3.3 t70 -123.87 177.31 5.81 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.427 176.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -136.2 137.74 41.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.048 0.451 . . . . 0.0 112.202 -172.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.519 ' HG1' HG21 ' A' ' 90' ' ' VAL . 0.6 OUTLIER -135.56 -169.3 2.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.669 174.122 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -42.93 99.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.145 0.497 . . . . 0.0 109.968 177.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.674 ' O ' ' HA ' ' A' ' 15' ' ' SER . 3.1 mp0 -81.57 43.29 0.74 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.47 -179.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 80.89 -170.37 52.97 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.974 -0.557 . . . . 0.0 113.52 173.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.446 ' O ' ' HB3' ' A' ' 15' ' ' SER . 11.0 Cg_exo -70.84 134.5 25.84 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 123.072 2.514 . . . . 0.0 111.369 174.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.519 HG21 ' HG1' ' A' ' 85' ' ' THR . 0.6 OUTLIER -132.81 -153.6 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.66 -174.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.566 ' HB3' ' O ' ' A' ' 114' ' ' GLY . 0.5 OUTLIER -94.45 152.87 18.26 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.428 -178.036 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.408 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 1.1 tttt -92.92 -34.82 13.63 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.29 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -159.12 -62.4 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 33.3 mt -112.27 132.6 60.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.905 0.383 . . . . 0.0 111.809 -171.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.514 ' H ' HG12 ' A' ' 95' ' ' VAL . 0.2 OUTLIER -105.16 139.02 27.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.489 175.824 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.411 ' CB ' ' HA ' ' A' ' 107' ' ' ALA . . . -149.94 167.57 26.29 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 121.22 0.534 . . . . 0.0 111.859 -176.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 4.2 t -112.46 114.71 27.54 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.103 176.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.621 ' O ' ' HA ' ' A' ' 31' ' ' SER . 46.8 t -135.05 106.72 10.39 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.799 -174.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.763 ' HD2' HG22 ' A' ' 102' ' ' THR . 25.9 Cg_exo -67.54 144.83 68.34 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.958 2.439 . . . . 0.0 112.251 173.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.633 ' HA ' ' HZ3' ' A' ' 69' ' ' LYS . 0.3 OUTLIER -77.32 72.03 3.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.494 0.664 . . . . 0.0 109.802 171.919 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.605 ' HA2' HD12 ' A' ' 55' ' ' LEU . . . 145.11 63.46 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.313 -177.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.763 HG22 ' HD2' ' A' ' 99' ' ' PRO . 12.0 t -148.29 156.69 42.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.943 0.401 . . . . 0.0 111.061 -176.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -38.54 87.18 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.521 177.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.977 ' HB2' ' HA ' ' A' ' 60' ' ' SER . 0.2 OUTLIER -155.14 159.49 40.22 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.735 176.589 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.46 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 1.8 m -111.63 140.39 46.28 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 176.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -96.74 136.81 26.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.235 0.541 . . . . 0.0 111.477 -175.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.411 ' HA ' ' CB ' ' A' ' 96' ' ' ALA . . . -90.83 130.04 36.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.924 176.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -95.22 -6.26 10.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.423 0.63 . . . . 0.0 111.013 -179.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -72.65 129.06 37.38 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.389 175.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -132.09 17.86 4.56 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.669 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -144.01 -27.18 0.53 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -176.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 98.63 45.72 2.25 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.156 -175.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -143.44 120.02 11.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.807 0.337 . . . . 0.0 110.62 -177.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . 0.566 ' O ' ' HB3' ' A' ' 91' ' ' CYS . . . -177.93 66.82 0.08 OUTLIER Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.53 -0.843 . . . . 0.0 112.444 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.58 -60.12 2.48 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.622 0.725 . . . . 0.0 109.575 174.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.668 ' HB3' ' HB1' ' A' ' 17' ' ' ALA . 13.7 mtmt -128.8 -120.99 0.23 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 174.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -120.92 135.71 55.13 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 171.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 . . . . . 0 C--O 1.252 1.211 0 CA-C-O 118.598 -0.715 . . . . 0.0 109.714 178.015 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.8 OUTLIER -56.62 135.5 77.73 Favored Pre-proline 0 CA--C 1.533 0.294 0 O-C-N 123.342 0.401 . . . . 0.0 111.051 178.185 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 2' ' ' LEU . 32.3 Cg_exo -59.77 99.48 0.13 Allowed 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 123.174 2.582 . . . . 0.0 112.921 -179.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -162.7 157.21 21.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.332 177.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.22 -1.79 34.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.187 0.517 . . . . 0.0 110.798 179.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -100.39 40.33 1.27 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.191 -177.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -87.52 59.57 5.55 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.16 0.505 . . . . 0.0 110.496 178.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.0 mtpt -129.52 4.34 5.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.132 -177.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.3 p-10 -127.62 24.31 6.18 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.239 0.542 . . . . 0.0 110.501 -179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -90.09 143.04 27.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.519 -178.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.7 mmtt -95.6 157.24 15.98 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.34 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.446 ' HB2' ' HB3' ' A' ' 15' ' ' SER . 5.2 mp -79.21 61.34 3.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.983 -177.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 36.82 74.05 0.08 Allowed 'General case' 0 N--CA 1.472 0.636 0 O-C-N 124.144 0.903 . . . . 0.0 112.986 175.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.27 62.71 1.14 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.602 0.715 . . . . 0.0 111.083 -177.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.446 ' HB3' ' HB2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -85.25 49.69 1.8 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.135 -177.316 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.67 -51.44 49.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.643 ' HB1' ' HE3' ' A' ' 116' ' ' LYS . . . -59.49 -33.08 70.89 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.479 176.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.564 ' HB2' HG13 ' A' ' 90' ' ' VAL . 23.7 t80 -70.25 -47.1 62.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.056 0.455 . . . . 0.0 110.335 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.8 -23.98 64.35 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.915 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -67.9 -25.08 65.31 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.847 0.832 . . . . 0.0 109.254 177.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.11 -38.16 11.75 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.409 -1.268 . . . . 0.0 110.601 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.73 -17.81 64.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.97 -176.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.62 -8.02 57.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.939 0.399 . . . . 0.0 110.677 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.31 1.72 37.45 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.802 -0.714 . . . . 0.0 111.44 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.578 HG21 HG23 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -114.65 124.55 52.12 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.297 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.43 94.59 2.1 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.08 0.467 . . . . 0.0 111.06 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.462 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 27.7 m -151.85 -177.53 6.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.036 179.052 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -112.7 151.32 30.36 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 176.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.9 t -58.29 -40.89 79.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.917 0.389 . . . . 0.0 111.066 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.51 8.33 54.58 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.486 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -143.58 32.46 1.3 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.944 0.402 . . . . 0.0 110.312 178.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.465 ' O ' HG21 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -95.9 134.86 31.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.678 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.57 ' HB3' ' HB3' ' A' ' 98' ' ' CYS . . . -149.2 170.88 17.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.254 0.549 . . . . 0.0 111.974 -175.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.2 t -118.26 141.87 48.07 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.829 173.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -126.17 156.29 40.39 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.398 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -156.2 160.37 39.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.172 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.583 ' HB2' ' OE1' ' A' ' 40' ' ' GLU . 1.5 m -59.61 148.45 74.64 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.069 -177.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.568 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 32.4 Cg_endo -65.79 -26.72 52.37 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.031 2.488 . . . . 0.0 113.424 -175.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.23 -11.92 58.71 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.142 0.496 . . . . 0.0 111.312 -176.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.583 ' OE1' ' HB2' ' A' ' 37' ' ' SER . 1.9 mp0 -108.17 -51.03 2.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.229 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.475 ' O ' ' HB3' ' A' ' 47' ' ' LEU . 1.2 t -69.63 -20.56 63.6 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.296 -176.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.568 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.1 m-80 -105.47 3.46 29.55 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 -178.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -71.76 -46.92 56.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.741 0.305 . . . . 0.0 111.386 -176.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 1.034 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 61.1 t0 -75.68 133.6 40.77 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 178.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -23.61 66.94 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.633 178.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.3 tp -87.14 -32.6 19.79 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.288 177.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 1.034 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -64.52 -34.22 77.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.145 -177.185 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.605 ' HA ' HD22 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -64.85 -18.12 64.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.074 179.734 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -102.73 -30.44 5.52 Favored Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 111.374 -0.69 . . . . 0.0 111.374 173.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.664 ' HG ' ' HB3' ' A' ' 76' ' ' LEU . 1.9 mp -60.28 -36.45 77.85 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 122.667 0.387 . . . . 0.0 110.992 178.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.605 HD22 ' HA ' ' A' ' 48' ' ' SER . 3.8 pp -73.4 -11.25 60.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.005 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.592 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -111.99 66.31 0.24 Allowed Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.227 -178.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.87 66.7 4.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.907 0.384 . . . . 0.0 111.4 -178.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 90.43 82.92 1.38 Allowed Glycine 0 C--O 1.226 -0.356 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.04 176.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.5 tp 63.27 20.57 12.35 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.857 0.463 . . . . 0.0 112.029 176.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.791 HD11 ' HZ1' ' A' ' 69' ' ' LYS . 0.2 OUTLIER -53.87 145.84 15.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.816 178.089 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.511 ' N ' HD13 ' A' ' 56' ' ' LEU . 17.4 t-20 -113.24 -178.23 3.33 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.452 177.18 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -109.03 -158.28 18.61 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.073 -176.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.567 ' CD2' ' HB3' ' A' ' 62' ' ' ASN . 1.2 tp -77.5 138.42 39.2 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 120.737 0.303 . . . . 0.0 110.216 178.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.578 ' HG ' HG12 ' A' ' 106' ' ' VAL . 50.6 m -53.34 108.05 0.3 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.444 -175.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.11 -12.87 64.9 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.549 173.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.567 ' HB3' ' CD2' ' A' ' 59' ' ' LEU . 18.8 t30 -127.92 114.57 17.34 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.321 0.581 . . . . 0.0 110.954 -178.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.11 160.08 30.11 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.919 -178.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.418 ' C ' ' HB3' ' A' ' 38' ' ' PRO . . . 94.92 -42.45 2.39 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.617 178.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.427 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 0.7 OUTLIER -81.98 117.62 22.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.874 0.369 . . . . 0.0 110.48 -178.761 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.16 143.86 34.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.08 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.68 128.69 55.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.028 0.442 . . . . 0.0 110.858 -178.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.881 ' HB1' HD12 ' A' ' 81' ' ' LEU . . . -112.78 129.83 56.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.95 -177.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.791 ' HZ1' HD11 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -95.94 173.27 7.53 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.539 -178.943 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.24 -29.94 66.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.911 0.386 . . . . 0.0 111.207 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -28.3 68.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.096 178.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.637 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 2.0 mp -86.37 -17.71 33.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.061 0.458 . . . . 0.0 110.586 -179.031 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -63.59 -41.53 92.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.969 177.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -89.52 -12.83 38.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.271 0.558 . . . . 0.0 110.564 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.637 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.5 OUTLIER -77.04 -53.53 7.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.222 -178.344 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.664 ' HB3' ' HG ' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -125.5 -29.99 3.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.312 -175.824 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.31 48.69 18.1 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 120.302 -0.951 . . . . 0.0 111.999 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.524 HD13 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -74.95 97.29 3.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.833 0.349 . . . . 0.0 111.129 -177.716 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.34 8.46 2.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.366 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.28 -27.28 47.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.019 0.438 . . . . 0.0 109.935 174.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.881 HD12 ' HB1' ' A' ' 68' ' ' ALA . 7.9 mt -117.83 -5.62 11.06 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.597 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 11.6 t -117.46 138.0 49.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.481 178.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -132.49 178.06 7.12 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.079 178.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -136.03 98.89 3.99 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.842 0.353 . . . . 0.0 111.205 -174.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.5 t -82.3 -173.6 4.65 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.866 175.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -78.72 55.36 1.67 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.076 0.465 . . . . 0.0 110.808 -178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -161.11 -59.88 0.05 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.854 -178.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -171.82 -174.48 39.39 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.811 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.09 121.3 7.92 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.755 2.303 . . . . 0.0 110.76 174.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.564 HG13 ' HB2' ' A' ' 18' ' ' PHE . 2.7 m -136.28 -174.31 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.211 0.529 . . . . 0.0 111.619 -170.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.49 130.62 43.62 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.902 177.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.1 tttt -71.91 -43.91 64.56 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.012 0.434 . . . . 0.0 110.311 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -149.56 -100.92 0.07 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.257 -173.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 6.7 mt -73.61 126.88 35.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.765 -169.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -89.57 133.14 32.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.242 177.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.478 ' HB3' ' O ' ' A' ' 106' ' ' VAL . . . -153.5 167.53 29.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.139 0.495 . . . . 0.0 111.83 -175.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.462 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -109.26 132.75 53.82 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 174.741 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.57 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 44.0 t -152.45 135.0 8.99 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-O 120.81 0.338 . . . . 0.0 111.636 -171.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.409 ' O ' ' HD2' ' A' ' 69' ' ' LYS . 75.2 Cg_endo -77.29 -177.84 4.14 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 123.411 2.741 . . . . 0.0 111.019 172.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -76.28 -121.59 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -176.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.764 ' HA2' HD22 ' A' ' 56' ' ' LEU . . . -92.52 51.7 2.69 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 121.074 -0.584 . . . . 0.0 112.983 -176.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.35 137.23 1.08 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 176.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.2 m 72.85 147.69 0.09 Allowed 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.24 0.962 . . . . 0.0 111.653 178.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -73.09 164.11 27.17 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.857 -177.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.525 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.8 OUTLIER -111.12 143.17 42.27 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.696 -179.966 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.578 HG12 ' HG ' ' A' ' 60' ' ' SER . 0.9 OUTLIER -100.69 138.7 24.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.057 0.456 . . . . 0.0 110.435 -177.693 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.431 ' HA ' ' HB3' ' A' ' 96' ' ' ALA . . . -97.98 122.93 41.7 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.935 178.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.578 HG23 HG21 ' A' ' 25' ' ' THR . 0.1 OUTLIER -98.23 14.2 4.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.265 0.555 . . . . 0.0 111.051 -177.288 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -123.54 120.93 34.31 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.893 174.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -142.79 4.57 1.5 Allowed 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.587 176.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -178.62 23.73 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.665 -175.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -110.28 -12.16 18.22 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.765 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . 68.76 57.87 0.4 Allowed 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.164 0.585 . . . . 0.0 111.45 175.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -72.84 116.44 5.64 Favored Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.744 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 33.1 m -160.1 101.28 1.41 Allowed 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.643 ' HE3' ' HB1' ' A' ' 17' ' ' ALA . 0.0 OUTLIER -98.37 2.2 47.71 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.835 179.624 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . 0.671 ' O ' ' HB2' ' A' ' 118' ' ' GLU . . . -82.64 73.89 9.65 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 172.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.671 ' HB2' ' O ' ' A' ' 117' ' ' ALA . 0.6 OUTLIER . . . . . 0 C--O 1.255 1.346 0 CA-C-N 113.833 -1.53 . . . . 0.0 107.569 -171.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.514 ' HB2' ' H ' ' A' ' 2' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.571 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.529 HD22 ' HA ' ' A' ' 2' ' ' LEU . 9.9 mt -119.82 133.04 23.86 Favored Pre-proline 0 C--N 1.328 -0.336 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 177.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 2' ' ' LEU . 12.1 Cg_exo -69.9 167.29 25.04 Favored 'Trans proline' 0 C--O 1.234 0.279 0 C-N-CA 123.14 2.56 . . . . 0.0 112.618 -178.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.62 -158.25 0.64 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.287 178.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.15 -61.59 1.54 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.92 0.39 . . . . 0.0 110.891 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.67 57.86 3.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.732 -175.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -118.81 81.45 1.7 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.11 178.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -152.11 36.59 0.54 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.747 -175.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -84.35 42.86 0.91 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.325 -177.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -123.68 134.8 53.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.461 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.2 mttm -138.26 -67.55 0.47 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.484 -179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.579 HD21 HD11 ' A' ' 73' ' ' ILE . 0.2 OUTLIER 74.89 -52.1 0.67 Allowed 'General case' 0 N--CA 1.469 0.475 0 O-C-N 123.911 0.757 . . . . 0.0 111.799 176.701 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.84 -33.74 76.35 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.091 0.472 . . . . 0.0 111.016 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -4.7 57.45 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.659 -179.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.503 ' HA ' ' HA3' ' A' ' 88' ' ' GLY . 4.1 m -83.26 92.22 7.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.185 -178.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.1 -31.46 67.81 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.33 0.586 . . . . 0.0 109.652 176.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.96 -31.81 72.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.185 176.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.576 ' HD1' ' HA ' ' A' ' 90' ' ' VAL . 22.8 t80 -73.23 -35.0 66.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.246 0.546 . . . . 0.0 109.836 176.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.63 -29.57 68.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.173 0.511 . . . . 0.0 110.463 174.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.1 tttt -66.74 -38.41 86.59 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 174.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.431 ' HG2' HG12 ' A' ' 95' ' ' VAL . 0.8 OUTLIER -61.55 -35.08 76.75 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.849 176.468 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.58 -11.59 60.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.53 -178.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.14 -35.04 6.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.137 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.15 -34.37 89.49 Favored Glycine 0 N--CA 1.451 -0.366 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 175.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.22 129.9 55.76 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 174.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.9 m -68.83 98.23 0.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -170.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.425 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 98.7 m -144.65 -178.16 5.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.031 -0.986 . . . . 0.0 108.595 174.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -101.17 150.41 22.97 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.191 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.5 -31.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.783 -177.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.5 -49.41 5.82 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.545 -0.836 . . . . 0.0 111.023 175.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.47 ' HB3' ' HA ' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -87.56 53.69 2.88 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.345 -0.428 . . . . 0.0 110.738 179.034 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.454 HG21 ' O ' ' A' ' 32' ' ' ILE . 9.0 tp -108.68 139.52 30.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.936 0.398 . . . . 0.0 110.694 -179.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.73 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . . . -150.21 -178.74 6.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.348 0.594 . . . . 0.0 112.003 -177.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.467 ' HB3' HD12 ' A' ' 81' ' ' LEU . 48.8 t -133.16 134.41 44.1 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 171.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.482 ' SG ' ' HB1' ' A' ' 96' ' ' ALA . 99.3 m -106.53 145.08 32.3 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.018 0.437 . . . . 0.0 110.232 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -139.21 150.87 46.04 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.595 ' HB2' ' OE1' ' A' ' 40' ' ' GLU . 0.3 OUTLIER -42.71 139.08 2.11 Favored Pre-proline 0 CA--C 1.536 0.418 0 O-C-N 123.877 0.736 . . . . 0.0 112.434 179.807 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.448 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 20.3 Cg_endo -59.86 -40.61 61.43 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.561 2.841 . . . . 0.0 114.038 -171.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.76 -19.96 65.17 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.22 0.533 . . . . 0.0 111.661 -174.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.595 ' OE1' ' HB2' ' A' ' 37' ' ' SER . 45.3 mp0 -100.37 -39.83 7.79 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.064 -179.09 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 47.4 m -64.93 -35.49 81.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.641 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.448 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -104.04 15.7 27.94 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.862 -177.748 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -59.69 -25.59 64.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.986 -174.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 1.049 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 15.2 t70 -121.61 135.28 55.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.476 -177.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.77 -35.08 72.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.671 0.272 . . . . 0.0 111.315 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.415 ' HB3' ' OD2' ' A' ' 44' ' ' ASP . 2.6 tp -76.47 -40.52 50.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.99 0.424 . . . . 0.0 110.046 178.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 1.049 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 2.7 tp -56.74 -42.94 80.15 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.935 176.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.542 ' HA ' HD11 ' A' ' 51' ' ' LEU . 15.9 m -64.75 -9.14 18.07 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.176 -0.466 . . . . 0.0 112.213 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -108.95 -5.08 31.18 Favored Glycine 0 C--O 1.228 -0.235 0 N-CA-C 111.214 -0.754 . . . . 0.0 111.214 174.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.701 ' HG ' HD23 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -84.68 -25.81 28.19 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.546 -0.327 . . . . 0.0 111.287 -176.698 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.545 ' HG ' ' HB1' ' A' ' 66' ' ' ALA . 0.0 OUTLIER -77.4 1.23 19.64 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.448 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -146.52 85.81 0.17 Allowed Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.259 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.412 ' HB3' HD12 ' A' ' 72' ' ' LEU . . . -76.56 51.71 0.75 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.266 0.555 . . . . 0.0 110.872 178.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 171.11 -99.9 0.15 Allowed Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -149.21 48.03 0.98 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.63 0.729 . . . . 0.0 109.621 176.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.475 HD23 ' O ' ' A' ' 99' ' ' PRO . 0.2 OUTLIER -87.92 -178.89 6.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.139 -176.842 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -140.94 -176.37 4.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.033 -175.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.537 ' HA3' ' HA ' ' A' ' 66' ' ' ALA . . . -113.55 -118.66 3.46 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.289 -175.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.45 140.22 58.59 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.62 0.247 . . . . 0.0 110.338 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.57 ' HA ' ' CB ' ' A' ' 104' ' ' ASN . 64.2 m -62.85 89.89 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.368 -178.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.67 -36.42 4.26 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.947 -0.644 . . . . 0.0 112.738 177.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -91.08 101.98 14.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.026 0.441 . . . . 0.0 111.214 -176.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.72 93.54 3.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.993 179.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 170.58 -54.28 0.19 Allowed Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.279 -0.729 . . . . 0.0 111.279 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.49 106.72 8.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 174.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.545 ' HB1' ' HG ' ' A' ' 51' ' ' LEU . . . -107.09 154.87 20.52 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.561 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 4.9 m -135.46 145.69 47.43 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -177.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.473 ' HB3' HD12 ' A' ' 78' ' ' LEU . . . -105.23 130.45 53.37 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.126 0.488 . . . . 0.0 110.454 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 1.003 ' HD3' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -84.3 161.78 20.32 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.585 -178.757 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.78 -36.3 69.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.743 0.306 . . . . 0.0 111.638 -178.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.416 ' HG ' ' HG3' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -64.86 -31.05 72.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.486 0.66 . . . . 0.0 110.123 178.38 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.44 HD11 ' HA ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -79.67 -33.51 41.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.564 179.255 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.579 HD11 HD21 ' A' ' 12' ' ' LEU . 41.0 mt -66.49 -34.49 70.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.558 177.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -73.5 -40.2 64.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.688 175.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.54 -55.09 5.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -174.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.701 HD23 ' HG ' ' A' ' 50' ' ' LEU . 3.7 mp -109.85 -28.33 8.83 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.915 -0.314 . . . . 0.0 111.133 -173.169 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.61 50.43 4.72 Favored Glycine 0 CA--C 1.516 0.15 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.526 173.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.64 ' HG ' HD22 ' A' ' 50' ' ' LEU . 4.7 mp -68.04 108.3 3.03 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.108 0.48 . . . . 0.0 111.546 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.471 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -90.69 12.06 20.24 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.887 178.995 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.04 -26.46 60.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.51 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.472 HD13 ' CB ' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -119.42 9.75 11.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.52 -175.627 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.4 t -104.62 136.56 37.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.747 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 28.3 t0 -117.13 168.99 9.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.072 0.463 . . . . 0.0 111.746 -176.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -56.96 147.47 23.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.405 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.437 HG23 ' C ' ' A' ' 88' ' ' GLY . 9.5 t -153.96 155.72 36.13 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.118 0.485 . . . . 0.0 111.752 -175.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.481 ' CD ' ' HZ1' ' A' ' 116' ' ' LYS . 0.0 OUTLIER -112.13 -0.55 15.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.554 0.692 . . . . 0.0 109.44 174.146 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.516 ' HB3' ' H ' ' A' ' 88' ' ' GLY . 7.6 tm-20 -115.0 -86.33 0.6 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.389 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.516 ' H ' ' HB3' ' A' ' 87' ' ' GLU . . . -141.89 155.04 25.23 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 172.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -45.32 119.53 2.63 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.185 2.59 . . . . 0.0 112.094 -179.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.576 ' HA ' ' HD1' ' A' ' 18' ' ' PHE . 1.6 m -120.04 179.85 1.95 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.722 -172.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 5.2 t -67.36 130.69 43.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.626 178.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.747 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttp -77.81 -30.43 51.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.578 -177.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -149.09 -89.07 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -171.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 4.9 mt -95.97 122.43 47.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.51 -169.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.532 ' H ' HG21 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -83.36 128.88 38.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.706 179.329 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.482 ' HB1' ' SG ' ' A' ' 35' ' ' CYS . . . -154.5 170.36 21.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.601 -178.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.425 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -115.31 124.0 50.17 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.978 0.418 . . . . 0.0 110.97 179.825 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 1.003 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 3.2 m -114.65 119.56 39.37 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.936 -178.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.475 ' O ' HD23 ' A' ' 56' ' ' LEU . 68.6 Cg_endo -75.5 139.74 23.36 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.327 2.018 . . . . 0.0 111.672 174.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.416 ' HG3' ' HG ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -77.29 140.86 40.14 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 174.711 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 118.15 -91.99 0.53 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.634 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.17 179.32 6.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.674 0.273 . . . . 0.0 111.134 -175.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.67 -167.59 0.21 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.383 -0.826 . . . . 0.0 113.045 174.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.57 ' CB ' ' HA ' ' A' ' 60' ' ' SER . 80.4 m-20 -98.03 173.3 7.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.656 0.741 . . . . 0.0 112.67 -162.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 29.2 m -112.28 141.71 45.66 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.1 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -95.58 143.57 11.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 120.821 0.343 . . . . 0.0 110.344 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -105.34 115.29 30.01 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 8.9 p -91.24 0.53 8.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.753 0.787 . . . . 0.0 111.37 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -148.63 146.83 28.38 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.857 175.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -121.54 13.24 10.89 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.382 -177.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -116.55 -62.93 1.52 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -177.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 83.73 74.2 1.23 Allowed Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 -172.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -78.01 88.85 4.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.942 0.401 . . . . 0.0 111.482 -175.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 89.65 -159.23 28.02 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.576 176.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 3.6 p -103.36 -79.43 0.54 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.332 0.587 . . . . 0.0 110.485 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.505 ' HG2' HG22 ' A' ' 90' ' ' VAL . 0.2 OUTLIER -150.88 20.9 0.79 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.885 177.307 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -110.49 117.35 33.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.47 -175.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.008 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.415 176.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.477 0.916 0 CA-C-O 120.601 0.239 . . . . 0.0 110.661 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.423 ' HA ' HD21 ' A' ' 2' ' ' LEU . 0.2 OUTLIER -178.33 115.62 0.24 Allowed Pre-proline 0 C--O 1.234 0.287 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.582 179.886 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.46 88.57 0.41 Allowed 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 123.164 2.576 . . . . 0.0 112.416 179.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -95.26 168.2 10.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.33 177.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.43 158.65 31.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.91 178.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 66.72 68.91 0.42 Allowed 'General case' 0 N--CA 1.463 0.199 0 O-C-N 123.813 0.696 . . . . 0.0 111.228 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -140.91 145.19 35.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.896 178.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -99.49 74.97 1.93 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.291 0.567 . . . . 0.0 110.407 -177.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -133.61 114.04 13.07 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.174 0.512 . . . . 0.0 111.375 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.76 133.66 3.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.794 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.812 ' HB3' ' HB2' ' A' ' 15' ' ' SER . 1.1 mtmt -126.07 144.29 50.78 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.416 -179.343 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.699 ' HG ' ' OG ' ' A' ' 15' ' ' SER . 0.1 OUTLIER -81.0 74.88 7.99 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 177.081 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 72.35 -31.0 0.22 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.771 0.829 . . . . 0.0 111.634 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.485 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -149.12 -68.56 0.21 Allowed 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.753 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.812 ' HB2' ' HB3' ' A' ' 11' ' ' LYS . 2.3 m 67.3 -67.95 0.16 Allowed 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.427 0.691 . . . . 0.0 112.555 176.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.655 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . 56.8 -87.39 0.02 OUTLIER 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.421 0.688 . . . . 0.0 111.21 -175.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.507 ' HB1' ' HG2' ' A' ' 87' ' ' GLU . . . -71.24 -35.77 71.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.876 0.37 . . . . 0.0 110.614 -179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.572 ' HB2' HG11 ' A' ' 90' ' ' VAL . 19.9 t80 -70.52 -16.71 62.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.618 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.75 -15.45 59.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.963 0.411 . . . . 0.0 110.549 177.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 3.4 mttt -83.26 -24.35 32.31 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 175.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -32.45 72.91 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.241 176.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.27 -17.14 64.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.879 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -101.09 -50.54 3.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.602 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.83 -17.78 69.75 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.704 -178.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.5 m -119.67 134.94 55.02 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.36 97.49 9.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.964 0.412 . . . . 0.0 110.98 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -140.32 -178.19 5.37 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.419 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -120.91 172.2 8.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.568 0.223 . . . . 0.0 110.94 -175.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.642 HG12 ' N ' ' A' ' 30' ' ' GLY . 14.5 p -61.77 -45.58 98.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.76 -175.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.642 ' N ' HG12 ' A' ' 29' ' ' VAL . . . -100.62 20.01 50.04 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.761 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 1.2 m -125.98 -5.58 6.79 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.552 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -80.09 126.45 39.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.591 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -148.25 160.31 43.08 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.291 0.567 . . . . 0.0 111.966 -170.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 m -114.58 139.23 49.77 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.428 174.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.62 160.16 29.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.838 0.351 . . . . 0.0 110.853 -176.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -145.74 160.03 42.31 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.758 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -51.4 150.69 6.12 Favored Pre-proline 0 CA--C 1.536 0.44 0 O-C-N 123.549 0.531 . . . . 0.0 111.321 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.484 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 47.2 Cg_exo -53.47 -49.02 18.82 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.082 2.521 . . . . 0.0 113.3 -171.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.06 -11.41 60.94 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -174.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.407 ' O ' ' HB2' ' A' ' 43' ' ' ASN . 0.1 OUTLIER -103.27 -43.85 5.33 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.085 0.469 . . . . 0.0 110.035 179.881 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.811 HG21 ' H ' ' A' ' 66' ' ' ALA . 0.6 OUTLIER -65.84 -34.28 77.8 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.147 176.104 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.686 HD21 HG23 ' A' ' 41' ' ' THR . 1.2 m-80 -104.16 14.69 29.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.312 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 4.5 t-20 -47.58 -38.7 14.95 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.537 -176.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.636 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 9.8 t70 -113.2 142.18 46.09 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.0 -35.21 74.54 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.231 0.332 . . . . 0.0 111.149 -179.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.37 -32.33 58.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.921 0.391 . . . . 0.0 109.954 178.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.636 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.6 OUTLIER -61.72 -39.36 91.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.522 -179.128 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.617 ' HA ' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -58.22 -31.38 67.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.478 179.505 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -84.13 -30.31 28.68 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.911 178.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.4 mp -69.28 -20.93 63.91 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.815 0.34 . . . . 0.0 111.096 -178.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 48' ' ' SER . 3.3 mt -74.01 -14.1 60.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.532 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.634 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -126.97 76.42 0.4 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.599 -0.81 . . . . 0.0 111.621 -177.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.91 -20.35 33.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.969 0.414 . . . . 0.0 110.798 -176.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -139.01 68.23 0.5 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.509 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 mt 53.03 45.89 27.86 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.389 0.614 . . . . 0.0 111.112 177.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.634 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -84.73 161.19 20.11 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.351 -177.305 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.577 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 30.8 t-20 -126.08 -177.68 4.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.875 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -100.03 -152.77 26.9 Favored Glycine 0 C--O 1.225 -0.444 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.009 -176.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.791 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -70.35 146.37 50.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.979 0.419 . . . . 0.0 110.864 179.938 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.4 m -59.23 98.04 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.516 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.39 4.89 65.79 Favored Glycine 0 C--O 1.229 -0.203 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.424 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.791 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 18.8 t30 -128.93 100.56 5.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.181 0.515 . . . . 0.0 110.796 -177.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.19 71.85 9.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.282 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -166.21 -61.71 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.981 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.71 113.44 18.9 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.023 0.439 . . . . 0.0 110.973 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.811 ' H ' HG21 ' A' ' 41' ' ' THR . . . -107.53 153.71 22.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.216 173.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.61 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 0.1 OUTLIER -126.53 141.04 52.0 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.538 -175.5 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.879 ' HB3' HD12 ' A' ' 81' ' ' LEU . . . -105.41 128.6 53.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.333 0.587 . . . . 0.0 110.043 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.636 ' HG2' ' HB2' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -76.83 170.17 16.96 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.724 -176.808 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.55 -27.74 67.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.879 0.371 . . . . 0.0 111.308 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.55 -31.11 63.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.945 0.879 . . . . 0.0 109.071 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.636 ' HB2' ' HG2' ' A' ' 69' ' ' LYS . 0.5 OUTLIER -80.96 -27.07 36.16 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.277 178.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 69' ' ' LYS . 23.8 mm -64.6 -42.77 96.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.724 176.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -20.57 63.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.385 177.065 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.521 ' HB3' HD12 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -70.38 -53.83 14.96 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.504 -177.075 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.521 HD12 ' HB3' ' A' ' 75' ' ' GLN . 0.7 OUTLIER -136.95 -5.92 1.89 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -171.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.44 51.92 7.01 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 119.799 -1.191 . . . . 0.0 112.12 -178.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.36 83.68 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.968 0.413 . . . . 0.0 111.781 -176.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.507 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -71.91 4.85 3.01 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -175.191 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.63 -23.13 42.82 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -175.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.879 HD12 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -125.57 -4.47 7.16 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.22 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.501 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -115.94 138.22 47.09 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.525 0 CA-C-O 121.513 0.673 . . . . 0.0 111.789 -177.382 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.866 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 21.7 t70 -112.96 153.44 28.02 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.962 -1.017 . . . . 0.0 108.578 176.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -117.65 103.33 9.93 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.998 -174.24 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 78.3 p -104.75 -168.69 1.51 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.396 175.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.03 -25.32 67.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.771 0.32 . . . . 0.0 111.043 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.655 ' HB3' ' HB3' ' A' ' 16' ' ' ALA . 2.5 mp0 -71.54 -32.01 67.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.286 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 130.2 -146.1 17.2 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.481 -0.866 . . . . 0.0 111.794 -178.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -74.76 108.7 2.76 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.958 2.439 . . . . 0.0 111.346 175.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.572 HG11 ' HB2' ' A' ' 18' ' ' PHE . 0.6 OUTLIER -122.41 162.51 22.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.05 -179.231 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -67.27 124.17 22.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.941 0.401 . . . . 0.0 110.52 -177.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.866 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 2.4 tttp -70.83 -24.0 62.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.827 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.41 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -152.8 -95.18 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.14 -174.343 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.485 HG22 ' HB3' ' A' ' 109' ' ' ASP . 0.5 OUTLIER -92.81 136.77 23.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.597 -173.024 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.446 ' H ' HG13 ' A' ' 95' ' ' VAL . 0.6 OUTLIER -97.61 129.23 48.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 172.829 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -140.8 163.8 31.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.921 0.391 . . . . 0.0 111.363 -174.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.84 109.08 19.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.159 177.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.761 ' O ' ' HA ' ' A' ' 31' ' ' SER . 64.1 m -110.87 116.79 51.51 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.505 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.0 132.9 14.56 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.273 1.982 . . . . 0.0 111.934 177.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.12 120.18 23.28 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.086 176.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.484 ' O ' ' HB ' ' A' ' 102' ' ' THR . . . 137.87 -52.01 0.76 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.077 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.484 ' HB ' ' O ' ' A' ' 101' ' ' GLY . 5.1 t 176.33 177.52 0.24 Allowed 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.506 -0.183 . . . . 0.0 110.506 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.568 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.6 OUTLIER 76.34 157.75 0.19 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.023 0.929 . . . . 0.0 112.517 179.092 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.577 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.3 OUTLIER -75.08 175.52 8.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.818 -175.023 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 10.9 m -112.11 141.9 45.22 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.884 -178.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.42 ' O ' HG23 ' A' ' 106' ' ' VAL . 2.7 m -91.88 138.94 18.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.616 174.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.7 128.93 44.73 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.434 ' H ' HG22 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -94.61 7.03 6.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.591 0.71 . . . . 0.0 110.781 -178.042 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.485 ' HB3' HG22 ' A' ' 94' ' ' ILE . 2.6 t70 -121.5 142.56 49.93 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.38 172.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -142.04 20.25 2.11 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.74 -178.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -135.46 -37.93 0.76 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.311 -177.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 86.05 55.09 2.58 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -176.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -112.46 179.07 4.09 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 110.545 -0.169 . . . . 0.0 110.545 -178.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -77.47 80.98 1.25 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.292 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.46 80.38 5.84 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.762 0.315 . . . . 0.0 110.915 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.538 ' HD3' HG13 ' A' ' 90' ' ' VAL . 0.0 OUTLIER -164.61 30.0 0.07 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.149 176.818 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -121.47 143.77 49.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.688 -175.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.428 ' OXT' ' HG3' ' A' ' 118' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.021 -0.99 . . . . 0.0 108.999 177.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.477 0.899 0 CA-C-O 120.279 0.085 . . . . 0.0 110.804 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 65.44 91.05 0.08 OUTLIER Pre-proline 0 N--CA 1.466 0.343 0 C-N-CA 123.026 0.53 . . . . 0.0 111.597 176.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.29 64.39 7.14 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 123.009 2.473 . . . . 0.0 112.151 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -76.97 -70.69 0.45 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.573 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 p -124.68 -93.07 0.51 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.868 0.366 . . . . 0.0 110.689 176.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.48 -11.57 23.65 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.557 -177.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.86 54.96 9.66 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 123.62 0.575 . . . . 0.0 111.627 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.72 101.49 4.31 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.375 -178.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -145.89 -8.1 0.55 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.722 -177.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -118.66 140.45 49.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.006 0.431 . . . . 0.0 111.825 -172.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.47 -59.78 1.21 Allowed 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.794 174.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.461 HD13 ' CD1' ' A' ' 18' ' ' PHE . 1.0 OUTLIER 75.53 -61.46 0.47 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.729 175.6 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.98 -41.37 64.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.161 0.505 . . . . 0.0 110.5 -178.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.21 6.39 8.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.901 -178.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.514 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 15.2 m -72.92 -25.78 61.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.14 174.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.94 -53.51 0.51 Allowed 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.906 0.754 . . . . 0.0 111.354 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.629 ' HB3' ' HB2' ' A' ' 116' ' ' LYS . . . -63.1 -33.01 74.54 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.858 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.606 ' HE2' ' SG ' ' A' ' 34' ' ' CYS . 15.9 t80 -72.14 -28.46 63.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.151 177.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.33 -22.32 63.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.748 177.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.538 ' HE2' ' HA ' ' A' ' 17' ' ' ALA . 55.4 mttm -67.63 -29.58 68.94 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.82 -31.91 73.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.639 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.13 -18.63 63.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.526 -177.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -108.66 -25.1 11.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.783 179.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -77.13 -26.43 61.97 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.319 179.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.474 HG21 HG21 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -137.99 155.44 48.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.666 0.269 . . . . 0.0 110.433 -179.649 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.16 95.73 9.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.198 0.523 . . . . 0.0 110.414 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -148.44 132.25 17.01 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.642 175.908 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -80.38 173.71 12.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.318 -177.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.8 p -55.78 -41.76 67.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 120.751 0.31 . . . . 0.0 111.356 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -95.36 12.36 68.02 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.295 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 99' ' ' PRO . 0.7 OUTLIER -130.68 16.35 5.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.949 0.404 . . . . 0.0 110.637 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -106.49 133.14 51.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 175.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.595 ' HB3' ' HA ' ' A' ' 69' ' ' LYS . . . -150.45 178.97 8.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.503 0.668 . . . . 0.0 112.319 -171.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.606 ' SG ' ' HE2' ' A' ' 18' ' ' PHE . 3.8 m -127.45 135.07 49.9 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.792 -1.095 . . . . 0.0 108.806 171.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.515 ' HB3' ' HB ' ' A' ' 94' ' ' ILE . 0.4 OUTLIER -110.92 158.41 18.77 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.111 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.627 ' OD1' ' HB3' ' A' ' 40' ' ' GLU . 11.0 t-20 -148.96 159.24 44.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.679 0.276 . . . . 0.0 110.843 -172.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.417 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -50.61 132.71 27.13 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.528 177.489 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 37' ' ' SER . 63.8 Cg_exo -53.38 -43.3 58.63 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.31 2.673 . . . . 0.0 113.42 -177.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.09 -8.12 52.82 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.969 0.414 . . . . 0.0 111.029 -177.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.627 ' HB3' ' OD1' ' A' ' 36' ' ' ASN . 1.5 tt0 -103.47 -46.81 4.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.563 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 43.8 m -60.18 -38.12 82.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.978 176.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -102.41 14.74 31.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.006 -177.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -62.4 -42.02 99.11 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.144 -177.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 1.033 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 21.7 t70 -87.57 140.88 29.07 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.531 178.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.26 -40.24 89.62 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.825 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.62 -19.73 22.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.046 -175.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 1.033 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -57.24 -35.64 69.96 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.209 -179.729 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.42 -23.32 67.35 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.87 0.366 . . . . 0.0 111.386 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -100.7 -19.07 18.83 Favored Glycine 0 C--N 1.33 0.229 0 N-CA-C 111.283 -0.727 . . . . 0.0 111.283 174.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.577 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 2.3 tp -64.34 -35.06 79.65 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 122.596 0.359 . . . . 0.0 110.904 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.479 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -72.43 -34.55 67.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.172 0.511 . . . . 0.0 110.637 178.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.21 53.37 4.76 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.568 -175.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.405 ' HB2' HD13 ' A' ' 72' ' ' LEU . . . -73.79 -27.48 61.16 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.4 0.619 . . . . 0.0 110.527 178.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -137.9 -94.28 0.33 Allowed Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.519 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.566 ' HB3' ' HA2' ' A' ' 101' ' ' GLY . 0.5 OUTLIER -130.23 58.82 1.65 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.94 0.4 . . . . 0.0 110.027 178.448 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.529 HD13 ' HA ' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -80.81 103.1 10.43 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.59 0.71 . . . . 0.0 110.146 177.885 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.665 HD21 ' HA ' ' A' ' 104' ' ' ASN . 2.2 p-10 -89.99 171.4 9.6 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 114.47 -1.241 . . . . 0.0 109.375 175.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.31 -160.12 34.3 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.581 -0.819 . . . . 0.0 113.168 -174.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.576 HD22 ' HB2' ' A' ' 107' ' ' ALA . 0.8 OUTLIER -67.98 159.33 30.88 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 122.545 0.338 . . . . 0.0 111.671 -178.303 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.571 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 0.4 OUTLIER -55.04 87.23 0.01 OUTLIER 'General case' 0 C--O 1.233 0.187 0 C-N-CA 123.841 0.856 . . . . 0.0 111.918 178.909 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.77 8.05 84.99 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.514 178.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -120.5 102.38 8.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.976 0.417 . . . . 0.0 111.509 -178.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.37 104.17 5.82 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.51 176.029 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 157.37 -61.38 0.33 Allowed Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.178 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.85 119.88 21.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.902 0.382 . . . . 0.0 110.073 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -114.27 135.83 53.64 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.197 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.07 132.36 56.68 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.529 ' HA ' HD13 ' A' ' 56' ' ' LEU . . . -103.78 129.32 51.18 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.055 0.455 . . . . 0.0 110.305 -177.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.595 ' HA ' ' HB3' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -75.63 168.03 20.79 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.323 -177.023 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.87 -31.88 67.13 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.678 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.6 -35.44 73.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.261 0.553 . . . . 0.0 109.541 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.533 HD11 HD11 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -76.89 -32.49 57.47 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.294 178.849 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.1 mt -60.81 -38.3 78.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.579 176.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.54 -24.47 49.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.033 177.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.04 -53.67 7.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.26 -0.427 . . . . 0.0 112.077 -175.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.577 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.9 OUTLIER -117.41 -24.43 7.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -172.9 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.89 50.59 6.85 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 119.974 -1.108 . . . . 0.0 112.367 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.801 HD21 HD22 ' A' ' 47' ' ' LEU . 2.4 mp -74.86 92.85 2.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.946 0.403 . . . . 0.0 110.735 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.409 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -77.46 6.51 6.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.713 -177.825 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.87 -44.86 79.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.236 0.541 . . . . 0.0 110.379 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.625 ' HA ' ' HB2' ' A' ' 36' ' ' ASN . 0.0 OUTLIER -94.74 2.83 55.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.231 -176.808 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 16.3 t -115.22 138.29 46.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.234 0.54 . . . . 0.0 110.826 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.646 ' HB2' ' HD3' ' A' ' 92' ' ' LYS . 31.7 t0 -128.97 164.69 22.62 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 175.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -110.23 135.81 50.41 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.081 0.467 . . . . 0.0 111.513 -176.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.61 HG23 HG22 ' A' ' 90' ' ' VAL . 2.1 p -120.92 -169.51 1.84 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.343 176.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -66.93 -32.49 73.78 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.745 0.653 . . . . 0.0 109.941 174.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.514 ' HB3' ' O ' ' A' ' 15' ' ' SER . 0.5 OUTLIER -72.93 -54.81 7.72 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.873 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 166.43 -152.13 20.93 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.253 -0.975 . . . . 0.0 112.403 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -70.09 120.75 7.43 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 123.001 2.467 . . . . 0.0 111.022 174.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.61 HG22 HG23 ' A' ' 85' ' ' THR . 0.9 OUTLIER -135.4 -175.16 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.948 0.404 . . . . 0.0 111.064 -174.855 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.51 125.27 26.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.791 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.646 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 14.3 tptm -68.89 -41.46 78.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.82 -177.194 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -146.68 -63.36 0.3 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.575 -172.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.515 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 2.2 mt -109.19 122.15 63.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.99 0.424 . . . . 0.0 111.718 -173.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.516 ' H ' HG13 ' A' ' 95' ' ' VAL . 0.2 OUTLIER -85.46 126.92 40.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.806 175.527 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.419 ' HB1' ' HA ' ' A' ' 107' ' ' ALA . . . -154.29 152.58 30.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.303 -176.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 6.9 m -104.17 107.87 18.97 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 176.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.527 ' HA ' ' HB3' ' A' ' 105' ' ' CYS . 53.9 t -119.66 117.25 32.79 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.571 -173.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.56 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 3.1 Cg_exo -80.01 154.8 22.76 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.047 2.498 . . . . 0.0 111.944 175.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.446 ' HG2' ' HG3' ' A' ' 69' ' ' LYS . 0.9 OUTLIER -88.27 100.89 13.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 171.885 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.566 ' HA2' ' HB3' ' A' ' 55' ' ' LEU . . . 110.73 68.42 0.57 Allowed Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.217 -0.992 . . . . 0.0 112.53 -178.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.444 HG23 ' HG2' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -146.28 -177.8 5.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.746 0.308 . . . . 0.0 111.081 -178.406 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 14.1 m -82.23 -47.88 11.92 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 172.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.665 ' HA ' HD21 ' A' ' 57' ' ' ASN . 18.0 p30 -154.63 163.69 39.86 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.138 174.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.527 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 34.7 m -112.34 141.99 45.4 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -97.25 132.21 42.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.184 0.516 . . . . 0.0 111.499 -172.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.576 ' HB2' HD22 ' A' ' 59' ' ' LEU . . . -88.45 130.97 35.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.503 173.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.474 HG21 HG21 ' A' ' 25' ' ' THR . 0.0 OUTLIER -108.98 25.13 2.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.938 -172.424 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -77.86 -55.48 5.28 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.501 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 9.0 m-80 69.06 -52.73 0.58 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.849 0.86 . . . . 0.0 112.157 177.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -129.19 -68.09 0.75 Allowed 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.987 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 170.51 89.35 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.185 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -79.8 -82.31 0.11 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.025 0.44 . . . . 0.0 110.19 178.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -166.96 -172.41 34.17 Favored Glycine 0 N--CA 1.445 -0.72 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.752 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.494 ' O ' ' HB3' ' A' ' 116' ' ' LYS . 0.8 OUTLIER -112.1 -15.98 13.14 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.585 0.231 . . . . 0.0 110.606 177.842 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.629 ' HB2' ' HB3' ' A' ' 17' ' ' ALA . 0.0 OUTLIER 164.71 3.39 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.21 -174.491 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -121.17 78.88 1.45 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.145 0.498 . . . . 0.0 110.28 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.248 1.012 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.861 -177.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.885 0 CA-C-O 120.579 0.228 . . . . 0.0 110.435 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.433 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.6 OUTLIER -116.87 119.07 35.79 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 175.745 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 2' ' ' LEU . 13.5 Cg_exo -71.27 64.18 2.74 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.459 2.773 . . . . 0.0 112.922 -177.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -96.21 -10.92 26.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.474 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 71.9 m -156.07 152.91 28.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.289 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.39 26.08 14.91 Favored 'General case' 0 N--CA 1.466 0.327 0 O-C-N 123.899 0.749 . . . . 0.0 111.938 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -90.11 67.44 6.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.934 0.397 . . . . 0.0 110.652 -179.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.5 mttm -140.83 137.53 33.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.367 -179.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 77.88 -36.16 0.21 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.414 0.686 . . . . 0.0 111.446 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 72.59 -85.05 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.562 0.745 . . . . 0.0 111.96 177.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.46 ' HB3' ' H ' ' A' ' 12' ' ' LEU . 5.1 mtmm -148.15 -153.24 0.48 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.204 0.526 . . . . 0.0 112.18 -173.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.748 HD11 ' HB1' ' A' ' 70' ' ' ALA . 6.3 mp -78.01 51.6 0.99 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.616 -175.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 69.26 -32.28 0.22 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.968 0.907 . . . . 0.0 111.774 -178.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.531 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -156.51 -57.42 0.09 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.413 ' OG ' ' HB3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER 47.6 46.78 17.86 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.189 -178.944 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.09 -62.02 2.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.943 0.401 . . . . 0.0 111.441 -173.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.565 ' HB3' ' HD2' ' A' ' 116' ' ' LYS . . . -76.11 -25.47 55.45 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.958 0.408 . . . . 0.0 110.76 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -64.66 -38.26 90.41 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.419 178.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.92 -19.92 64.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.492 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.88 -30.08 63.68 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -72.6 -26.16 61.59 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.289 176.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.0 -5.55 44.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.79 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -81.01 -21.36 40.27 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.151 0.501 . . . . 0.0 110.18 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.78 -27.71 49.51 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.703 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.39 113.17 7.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.865 0.364 . . . . 0.0 110.942 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.9 m -68.66 113.38 6.1 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.925 175.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.452 ' HB3' HG13 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -148.6 161.77 41.03 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.698 178.414 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.414 ' H ' ' HB2' ' A' ' 31' ' ' SER . 17.0 t-20 -87.44 171.49 10.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.777 -176.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.8 m -63.86 -36.81 77.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.831 0.348 . . . . 0.0 110.599 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -92.39 25.29 18.7 Favored Glycine 0 N--CA 1.451 -0.326 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 175.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.486 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 1.4 m -142.79 -9.19 0.81 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.069 0.462 . . . . 0.0 110.523 177.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.452 HG13 ' HB3' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -94.81 133.79 34.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 177.596 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.59 165.54 30.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.459 0.647 . . . . 0.0 112.625 -171.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.4 t -124.5 144.51 50.06 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.798 -1.092 . . . . 0.0 109.309 173.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.556 ' HB3' HG12 ' A' ' 94' ' ' ILE . 0.1 OUTLIER -124.41 155.53 38.67 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.771 0.319 . . . . 0.0 110.402 -179.311 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -134.59 159.49 41.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.737 178.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.38 142.9 67.58 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.789 178.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.416 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 74.2 Cg_exo -51.49 -33.04 45.73 Favored 'Trans proline' 0 N--CA 1.478 0.567 0 C-N-CA 123.797 2.998 . . . . 0.0 113.847 -174.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.83 -7.65 23.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.023 0.439 . . . . 0.0 111.56 -178.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -113.38 -39.98 3.98 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.202 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.19 -33.32 75.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.44 0.638 . . . . 0.0 110.61 176.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 2.2 m-80 -102.92 14.05 32.87 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.274 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -66.34 -28.95 69.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.614 -176.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.933 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 7.3 t0 -115.06 140.86 48.71 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.871 177.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -26.3 66.0 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.991 0.424 . . . . 0.0 110.745 177.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.444 ' HA ' HD12 ' A' ' 46' ' ' LEU . 1.0 OUTLIER -86.0 -24.0 26.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.175 177.756 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.933 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -62.12 -42.63 99.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.249 -177.436 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.878 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -65.38 -26.97 68.23 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.708 -175.562 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.84 -21.35 33.9 Favored Glycine 0 C--N 1.329 0.151 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.349 174.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.723 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 1.2 tp -70.72 -35.82 72.9 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.473 -0.363 . . . . 0.0 110.564 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.878 HD21 ' HA ' ' A' ' 48' ' ' SER . 1.6 pp -74.15 -26.13 60.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.241 -178.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.95 58.01 2.88 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.696 -177.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.435 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -79.55 59.61 3.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.075 0.464 . . . . 0.0 111.575 -176.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 120.22 70.14 0.31 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.615 176.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 15.0 mt 56.59 32.55 21.14 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.351 0.596 . . . . 0.0 111.363 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.88 145.0 31.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.099 -177.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.67 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 4.6 t-20 -120.68 -178.24 3.67 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -116.3 -122.7 3.44 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.521 -0.847 . . . . 0.0 112.245 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.697 HD23 ' HB2' ' A' ' 65' ' ' SER . 1.8 mm? -65.31 144.09 57.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.683 0.277 . . . . 0.0 110.726 -179.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.586 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -58.17 94.16 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.813 -179.793 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.42 -8.02 79.51 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 121.125 -0.56 . . . . 0.0 113.237 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -105.57 141.46 36.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.446 0.641 . . . . 0.0 111.583 -175.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -104.37 136.37 44.08 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.78 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 112.74 -39.29 2.91 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.886 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.697 ' HB2' HD23 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -97.46 116.22 29.25 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.592 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.32 150.81 49.91 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.491 -178.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.401 ' HA ' HD21 ' A' ' 81' ' ' LEU . 0.1 OUTLIER -129.97 146.72 51.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.673 0.273 . . . . 0.0 110.932 -177.019 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.424 ' HB1' HD12 ' A' ' 81' ' ' LEU . . . -114.83 155.21 27.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.156 178.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.467 ' HD2' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -100.44 174.85 5.91 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.814 -173.545 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.748 ' HB1' HD11 ' A' ' 12' ' ' LEU . . . -61.3 -39.34 90.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.111 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.5 -36.42 83.79 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.979 0.418 . . . . 0.0 110.488 177.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.639 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 1.2 tp -72.88 -21.85 60.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.844 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.677 HD11 ' HA ' ' A' ' 70' ' ' ALA . 0.2 OUTLIER -60.43 -40.22 83.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.874 176.369 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -88.27 2.17 52.96 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.317 0.58 . . . . 0.0 110.736 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.639 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.4 OUTLIER -94.23 -53.66 3.86 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.062 -177.861 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.723 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.8 OUTLIER -121.02 -16.05 8.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 -174.246 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.77 49.09 45.0 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.326 -0.94 . . . . 0.0 112.075 -179.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.72 98.47 4.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.905 0.383 . . . . 0.0 111.272 -176.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 3.82 11.3 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.406 179.259 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.46 -41.11 80.67 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -177.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.424 HD12 ' HB1' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -116.83 4.0 12.94 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -174.097 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.4 t -111.18 136.71 46.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.292 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.698 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 5.5 t0 -119.33 168.19 11.17 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -129.97 99.1 4.97 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.936 0.398 . . . . 0.0 111.189 -177.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.422 ' OG1' HG21 ' A' ' 90' ' ' VAL . 41.4 p -96.88 -169.09 1.81 Allowed 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 173.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -81.87 8.22 10.88 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.313 0.578 . . . . 0.0 110.081 175.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -104.74 4.29 32.24 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.645 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 99.69 -161.24 19.55 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.139 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -65.2 116.9 4.12 Favored 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.853 2.369 . . . . 0.0 111.237 173.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.502 ' HB ' ' HD3' ' A' ' 116' ' ' LYS . 2.5 m -134.19 177.78 6.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.04 0.448 . . . . 0.0 111.717 -172.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.7 130.89 44.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.473 177.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.698 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttm -82.38 -32.89 28.96 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.884 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -141.8 -94.55 0.13 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.768 -174.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.556 HG12 ' HB3' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -107.0 147.73 11.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.015 0.436 . . . . 0.0 111.217 -172.748 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.408 ' H ' HG11 ' A' ' 95' ' ' VAL . 3.3 p -100.66 139.55 21.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.431 -179.221 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.482 ' HB3' ' HA ' ' A' ' 107' ' ' ALA . . . -146.49 160.67 41.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.001 0.429 . . . . 0.0 111.694 -175.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 1.3 m -104.89 107.73 18.86 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 174.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.727 ' HA ' ' HB3' ' A' ' 105' ' ' CYS . 9.9 t -124.62 108.47 28.79 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.901 -169.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.534 ' HD2' ' SG ' ' A' ' 105' ' ' CYS . 56.9 Cg_endo -69.47 126.71 13.83 Favored 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 122.633 2.222 . . . . 0.0 112.568 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.17 104.43 6.69 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 164.11 -67.46 0.22 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.399 -0.905 . . . . 0.0 112.687 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -161.59 159.13 27.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.751 0.276 . . . . 0.0 111.353 -177.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.3 m 72.53 166.95 0.31 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.584 0.707 . . . . 0.0 112.699 171.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.67 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.4 OUTLIER -74.46 163.5 27.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.312 -172.036 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.727 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 9.3 m -120.34 144.59 47.78 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.941 -175.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -90.66 148.31 4.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.482 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.482 ' HA ' ' HB3' ' A' ' 96' ' ' ALA . . . -109.52 140.39 43.36 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.497 178.495 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -100.98 -0.26 10.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.512 0.672 . . . . 0.0 111.051 -178.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.417 ' OD2' ' HB ' ' A' ' 94' ' ' ILE . 1.9 t70 -99.01 163.72 12.47 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.284 176.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -130.57 -8.19 4.11 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.567 0.581 . . . . 0.0 112.567 -177.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -159.86 24.31 0.18 Allowed 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -174.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 69.92 33.75 70.66 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.518 178.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.74 67.16 8.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.188 0.518 . . . . 0.0 110.623 -178.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -92.79 61.21 2.35 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.384 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.02 -21.32 64.13 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.645 0.259 . . . . 0.0 110.969 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.565 ' HD2' ' HB3' ' A' ' 17' ' ' ALA . 2.1 mtmp? 70.23 -74.12 0.09 Allowed 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 123.321 0.649 . . . . 0.0 110.866 -177.038 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -118.88 113.23 20.72 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 117.963 -1.018 . . . . 0.0 108.967 -177.007 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.449 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 1.1 mp -127.64 140.06 37.02 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.481 -179.081 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 2' ' ' LEU . 11.9 Cg_exo -70.78 -36.42 8.11 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.803 2.335 . . . . 0.0 112.082 177.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 54.88 31.93 16.79 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 175.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.8 m 63.23 21.58 12.91 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.805 -178.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.41 -9.45 35.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.471 176.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.29 -85.28 0.34 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.613 -175.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.9 tttt 59.4 60.1 2.43 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.312 0.577 . . . . 0.0 109.462 -172.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -100.72 -43.29 6.18 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.562 -171.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 48.69 74.4 0.18 Allowed 'General case' 0 C--O 1.233 0.217 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 178.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 59.8 mttt -58.94 -82.91 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 172.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.522 HD21 ' HA ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER 68.3 -55.78 0.51 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 114.647 -1.16 . . . . 0.0 112.162 176.716 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.14 -32.18 38.95 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.631 -177.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.73 5.11 4.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.863 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.437 ' O ' ' HB2' ' A' ' 87' ' ' GLU . 94.5 p -80.97 -34.33 33.2 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.09 -53.22 0.47 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.914 0.886 . . . . 0.0 111.27 -175.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.612 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . . . -66.82 -24.55 66.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.77 -177.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.652 ' HB2' HG11 ' A' ' 90' ' ' VAL . 36.3 t80 -87.9 -25.99 22.96 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.17 174.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.43 -40.21 93.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.272 178.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.612 ' HD3' ' HA ' ' A' ' 17' ' ' ALA . 0.0 OUTLIER -69.54 -24.51 63.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.462 0.649 . . . . 0.0 109.815 176.599 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.559 HE21 ' HA ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -74.63 -34.01 62.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.05 177.58 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.78 -18.51 64.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.758 -177.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -87.05 -1.14 57.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.984 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -73.98 -26.37 69.09 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.069 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.56 172.32 13.06 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.99 96.9 1.36 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.986 0.422 . . . . 0.0 109.936 173.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 66.7 m -130.49 134.59 47.2 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.85 -175.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -145.45 -163.08 1.64 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.463 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.5 ' O ' HG12 ' A' ' 29' ' ' VAL . 1.6 p -61.96 135.23 26.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.996 0.427 . . . . 0.0 110.121 177.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.93 -8.19 4.82 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 120.964 -0.636 . . . . 0.0 113.226 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.415 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -114.1 -6.35 13.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.952 0.405 . . . . 0.0 110.698 179.936 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.418 HG22 ' HB3' ' A' ' 70' ' ' ALA . 0.1 OUTLIER -91.68 128.79 43.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.84 177.2 10.03 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.063 0.458 . . . . 0.0 111.707 -174.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.3 m -140.54 147.47 39.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.625 173.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -128.33 160.27 32.71 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.238 0.542 . . . . 0.0 111.039 -176.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 42.6 t-20 -153.78 159.98 42.09 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.129 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -48.58 137.88 12.13 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 123.636 0.585 . . . . 0.0 111.452 177.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.577 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 10.0 Cg_endo -52.91 -35.21 69.88 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.281 2.654 . . . . 0.0 112.94 -179.398 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.44 -19.88 62.47 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.82 0.343 . . . . 0.0 111.735 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -91.92 -52.45 4.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.136 0.493 . . . . 0.0 110.018 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.546 ' O ' ' HB3' ' A' ' 47' ' ' LEU . 1.2 t -69.99 -21.05 63.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.643 -177.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.577 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -105.94 7.46 32.1 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.478 -179.043 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -66.8 -34.49 77.93 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.323 0.582 . . . . 0.0 110.704 -178.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 1.098 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 13.3 t0 -96.37 134.68 39.22 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.216 177.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.19 -24.82 68.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.815 0.341 . . . . 0.0 111.244 -179.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.2 tp -91.76 -22.08 20.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.935 0.398 . . . . 0.0 110.831 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 1.098 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -66.08 -31.68 72.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.007 -177.144 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.94 -14.52 63.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.243 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -104.82 -20.03 10.37 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.598 173.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.585 ' HB3' HD12 ' A' ' 78' ' ' LEU . 1.1 mp -73.35 -22.37 60.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.889 0.376 . . . . 0.0 111.185 -177.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.494 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -75.63 -12.55 60.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.327 -178.737 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.571 ' HA2' HD22 ' A' ' 56' ' ' LEU . . . -138.27 86.53 0.22 Allowed Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.561 -178.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.37 -21.69 66.71 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -177.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.59 67.12 0.37 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.353 -0.927 . . . . 0.0 113.044 179.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 mp 61.49 40.89 13.28 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.157 0.503 . . . . 0.0 111.74 173.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.603 HD23 ' HE3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -72.86 172.45 10.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.414 -178.371 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -117.03 -177.83 3.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.86 -176.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -116.34 -151.49 9.65 Favored Glycine 0 C--O 1.228 -0.271 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.209 -175.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.443 HD21 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -66.43 134.75 53.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.839 0.352 . . . . 0.0 110.308 177.958 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.48 105.78 1.01 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.798 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 102.15 -38.7 3.06 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.453 176.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -95.98 102.87 14.72 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.666 0.27 . . . . 0.0 110.653 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.15 71.38 2.89 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.015 0.436 . . . . 0.0 111.103 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -160.83 -58.76 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.012 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.18 139.62 44.57 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.877 0.37 . . . . 0.0 111.158 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.433 ' O ' HD22 ' A' ' 81' ' ' LEU . . . -128.31 131.68 48.65 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 176.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 m -115.71 131.69 56.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.103 0.477 . . . . 0.0 110.688 -176.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.547 ' H ' HD11 ' A' ' 81' ' ' LEU . . . -104.37 144.0 32.24 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.849 -177.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.693 ' HG3' ' HG2' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -89.82 161.26 16.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.49 -174.088 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.459 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -58.38 -25.64 62.28 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -175.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.86 -27.15 60.14 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.808 0.813 . . . . 0.0 109.005 -177.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.467 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -90.93 -17.12 26.94 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.306 -178.461 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.459 HD12 ' HA ' ' A' ' 70' ' ' ALA . 1.3 mt -66.15 -39.42 84.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.3 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.22 7.91 20.32 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.126 0.489 . . . . 0.0 110.731 177.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.478 ' HB3' HD13 ' A' ' 76' ' ' LEU . 0.8 OUTLIER -88.27 -53.41 4.71 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.763 -179.31 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.478 HD13 ' HB3' ' A' ' 75' ' ' GLN . 0.8 OUTLIER -135.2 0.83 2.88 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -173.238 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.78 52.98 4.16 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 119.718 -1.229 . . . . 0.0 113.055 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.585 HD12 ' HB3' ' A' ' 50' ' ' LEU . 4.5 mm? -67.97 66.56 0.1 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 122.663 0.385 . . . . 0.0 111.849 -178.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.34 -4.87 28.49 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -175.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.492 ' HB1' HD11 ' A' ' 47' ' ' LEU . . . -79.48 -31.23 42.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.76 0.314 . . . . 0.0 111.623 -176.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.547 HD11 ' H ' ' A' ' 68' ' ' ALA . 28.0 mt -102.81 -21.95 13.96 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.955 0.407 . . . . 0.0 111.177 -174.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -110.28 138.17 39.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.196 178.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.714 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 16.5 t0 -110.78 158.66 18.42 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.748 176.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -116.28 116.33 27.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.257 0.551 . . . . 0.0 111.575 -177.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.467 ' HG1' ' CG2' ' A' ' 90' ' ' VAL . 2.5 p -107.94 -175.47 2.79 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.397 -0.82 . . . . 0.0 108.873 174.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -66.12 -27.74 68.28 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.805 0.336 . . . . 0.0 111.448 -177.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 15' ' ' SER . 1.1 pm0 -70.65 -39.59 73.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.032 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 151.62 -159.79 28.45 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.108 -178.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -71.57 122.31 8.48 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 123.056 2.504 . . . . 0.0 111.286 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.652 HG11 ' HB2' ' A' ' 18' ' ' PHE . 1.5 m -138.51 169.83 17.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.76 -175.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.56 127.21 31.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.724 0.297 . . . . 0.0 110.481 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.714 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 2.0 tttt -67.36 -64.45 0.85 Allowed 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.082 -173.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.48 -61.8 1.37 Allowed 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.512 -172.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.9 mt -108.83 119.24 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.107 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.4 p -79.85 112.05 17.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.416 0.627 . . . . 0.0 109.831 175.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -151.02 137.69 18.83 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.068 -176.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 1.2 m -104.66 149.87 25.19 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.975 0.417 . . . . 0.0 110.482 -176.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.415 ' O ' ' HA ' ' A' ' 31' ' ' SER . 7.2 t -148.08 136.35 11.25 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.079 -167.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -81.95 152.19 16.62 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.701 2.267 . . . . 0.0 111.927 178.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.693 ' HG2' ' HG3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -89.43 157.24 18.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.864 0.364 . . . . 0.0 110.094 175.532 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 96.87 -56.31 1.32 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.068 -0.587 . . . . 0.0 111.99 -178.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.7 t -177.97 -173.77 0.4 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.7 m 74.75 148.66 0.1 Allowed 'General case' 0 C--N 1.33 -0.251 0 O-C-N 123.849 0.718 . . . . 0.0 111.195 -177.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -74.29 174.6 8.59 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.467 -175.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.411 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -109.98 146.82 34.61 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.894 177.502 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -102.05 138.44 26.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.853 0.359 . . . . 0.0 110.356 -177.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -110.48 108.32 18.28 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 4.9 p -74.88 -4.15 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.735 0.779 . . . . 0.0 111.622 -173.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.584 ' O ' ' HB2' ' A' ' 110' ' ' ASN . 0.0 OUTLIER -119.56 -26.08 5.84 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.41 179.585 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.584 ' HB2' ' O ' ' A' ' 109' ' ' ASP . 3.7 m-80 78.68 -60.49 0.38 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.352 -174.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -179.06 108.17 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.962 179.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 155.33 -20.55 0.55 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.791 176.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -121.37 129.22 52.92 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.298 0.571 . . . . 0.0 111.501 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -176.74 -162.96 28.24 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 178.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 56.04 46.41 21.81 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 120.95 0.405 . . . . 0.0 111.608 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.61 ' HG2' HG13 ' A' ' 90' ' ' VAL . 6.4 mtmt 72.61 14.2 5.18 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.292 173.065 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -72.31 105.48 4.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.065 0.46 . . . . 0.0 111.677 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.538 ' HB3' ' NZ ' ' A' ' 20' ' ' LYS . 3.1 tm-20 . . . . . 0 C--O 1.244 0.812 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 121.083 0.468 . . . . 0.0 110.438 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.543 HD22 ' HD2' ' A' ' 3' ' ' PRO . 0.1 OUTLIER -159.07 145.48 12.5 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.58 -176.925 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.543 ' HD2' HD22 ' A' ' 2' ' ' LEU . 50.6 Cg_exo -55.16 -51.01 11.16 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.244 1.963 . . . . 0.0 110.957 174.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 54.9 29.14 11.55 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.53 173.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.84 -45.8 33.86 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.366 0.603 . . . . 0.0 109.602 175.105 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -132.31 52.61 2.06 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.465 176.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -136.87 130.85 32.34 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.396 -177.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.632 ' HG3' ' HA3' ' A' ' 77' ' ' GLY . 1.2 tptt 63.73 48.26 3.34 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.392 0.615 . . . . 0.0 110.481 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -77.98 58.58 1.98 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.045 -179.388 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -117.15 100.08 7.48 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.311 -179.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -98.69 -59.76 1.67 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.361 179.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.528 HD12 ' HB2' ' A' ' 70' ' ' ALA . 0.1 OUTLIER 73.44 -48.91 0.68 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.519 0.728 . . . . 0.0 112.474 174.495 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.83 -30.83 71.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.923 0.392 . . . . 0.0 111.239 -179.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.31 -17.15 56.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.407 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.15 74.43 6.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.43 179.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.65 -40.14 62.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.549 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.64 ' HB1' ' HB2' ' A' ' 116' ' ' LYS . . . -61.58 -31.0 71.04 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.893 -177.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.436 ' HB2' HG12 ' A' ' 90' ' ' VAL . 88.8 t80 -70.18 -43.95 69.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.118 0.485 . . . . 0.0 110.111 -179.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.22 -30.24 48.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.366 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -63.3 -35.46 80.43 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.664 0.745 . . . . 0.0 109.237 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -30.43 67.17 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.526 176.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.56 -8.54 56.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.649 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.89 -5.62 59.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.031 0.443 . . . . 0.0 110.273 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.24 -9.16 55.93 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.156 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.5 m -134.57 152.78 52.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.82 95.58 7.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.14 0.495 . . . . 0.0 111.655 -177.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.5 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -140.95 155.91 46.16 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 173.206 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -112.85 -179.32 3.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.533 0.206 . . . . 0.0 110.481 -174.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 29' ' ' VAL . 2.1 m -60.38 138.07 21.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 176.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 80.11 -13.84 24.12 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.321 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.685 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -104.93 -2.94 23.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.79 0.295 . . . . 0.0 111.228 179.556 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.471 ' H ' HG12 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -81.26 106.12 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 176.9 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.656 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -122.25 144.92 48.68 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.991 0.424 . . . . 0.0 111.649 -173.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 5.5 t -107.98 133.37 52.4 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.519 174.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.69 ' HB2' ' HB ' ' A' ' 94' ' ' ILE . 37.5 m -112.68 149.66 32.58 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.51 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.424 ' HB2' HD21 ' A' ' 81' ' ' LEU . 38.1 t-20 -136.56 152.8 50.89 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 174.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m -45.8 133.8 6.6 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 123.485 0.49 . . . . 0.0 110.884 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_endo -47.02 -44.92 22.25 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 124.043 3.162 . . . . 0.0 114.351 -172.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.1 -11.24 60.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.952 0.406 . . . . 0.0 111.835 -176.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.92 -38.66 6.91 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.752 HG21 HD13 ' A' ' 47' ' ' LEU . 1.4 m -60.26 -43.12 96.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.21 173.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -90.01 5.88 44.68 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.192 -176.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -81.19 -7.61 59.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.427 0.632 . . . . 0.0 109.646 175.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -96.34 144.16 26.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.349 177.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -82.32 -21.68 35.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.329 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 mp -82.06 -52.86 6.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.619 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.752 ' HA ' ' HB3' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -54.05 -36.62 63.28 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.935 179.994 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 t -58.75 -25.23 62.79 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.401 -178.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -105.72 -24.06 7.19 Favored Glycine 0 C--N 1.334 0.422 0 N-CA-C 111.534 -0.627 . . . . 0.0 111.534 173.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.83 HD13 ' HG ' ' A' ' 72' ' ' LEU . 0.4 OUTLIER -67.87 -20.06 65.09 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 122.75 0.42 . . . . 0.0 110.783 179.189 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.493 ' HG ' ' HB3' ' A' ' 66' ' ' ALA . 0.0 OUTLIER -46.08 -35.23 4.73 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.652 0.595 . . . . 0.0 111.736 177.489 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.8 79.34 0.32 Allowed Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.485 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.404 ' CB ' HD12 ' A' ' 72' ' ' LEU . . . -67.53 -28.34 67.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.556 0.693 . . . . 0.0 109.251 174.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -133.96 -107.55 0.99 Allowed Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 110.361 -1.096 . . . . 0.0 110.361 172.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.1 mt -117.68 47.13 1.6 Allowed 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 174.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 mt -78.0 176.17 9.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.877 -174.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.572 ' CB ' ' HA ' ' A' ' 104' ' ' ASN . 3.0 m120 -138.83 -177.43 4.87 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.737 -175.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -112.41 -135.86 6.59 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.671 -0.775 . . . . 0.0 112.089 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.621 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -64.88 150.23 48.11 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.855 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.436 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -55.06 89.07 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.094 0.557 . . . . 0.0 112.099 -179.78 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.92 2.29 61.14 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 121.079 -0.582 . . . . 0.0 112.443 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.621 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 32.5 t-20 -122.35 98.22 5.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.944 0.402 . . . . 0.0 110.345 -179.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.16 72.7 9.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.237 0.542 . . . . 0.0 111.134 178.172 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.72 -48.17 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 -179.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -81.23 113.47 19.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 174.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.493 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . . . -105.78 156.05 18.69 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.835 0.35 . . . . 0.0 111.011 -176.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.4 m -134.42 141.73 46.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.041 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.581 ' HB3' HD21 ' A' ' 50' ' ' LEU . . . -108.06 126.01 52.24 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.935 0.398 . . . . 0.0 110.454 176.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.731 ' HZ2' ' HB2' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -80.77 166.42 21.0 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.694 175.758 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.528 ' HB2' HD12 ' A' ' 12' ' ' LEU . . . -50.72 -38.42 47.18 Favored 'General case' 0 C--N 1.329 -0.297 0 O-C-N 123.433 0.458 . . . . 0.0 111.813 180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.3 -37.31 80.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.592 179.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.83 ' HG ' HD13 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -82.77 -23.24 34.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.71 -178.292 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.4 mt -63.88 -40.26 88.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 173.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -83.74 -4.34 58.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.118 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.765 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -81.7 -53.46 6.2 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 120.972 0.415 . . . . 0.0 110.58 -179.245 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.609 HD23 HD11 ' A' ' 50' ' ' LEU . 6.7 mp -110.98 -21.92 11.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.015 -176.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.632 ' HA3' ' HG3' ' A' ' 8' ' ' LYS . . . 82.41 46.09 6.64 Favored Glycine 0 CA--C 1.511 -0.186 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.275 -176.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.553 HD23 ' HB3' ' A' ' 80' ' ' ALA . 0.0 OUTLIER -76.79 147.18 37.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -174.036 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.84 14.9 5.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.328 174.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.553 ' HB3' HD23 ' A' ' 78' ' ' LEU . . . -79.1 -25.65 43.01 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.023 0.44 . . . . 0.0 111.09 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.472 ' HG ' HD11 ' A' ' 47' ' ' LEU . 8.1 mt -109.68 4.13 21.66 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.704 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -116.71 138.24 47.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.353 0.597 . . . . 0.0 110.819 -176.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.609 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 6.8 t0 -119.62 144.12 47.3 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 175.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -103.94 112.15 25.0 Favored 'General case' 0 C--N 1.316 -0.854 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.067 -174.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.736 ' HG1' HG21 ' A' ' 90' ' ' VAL . 39.0 p -107.46 -169.36 1.52 Allowed 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.963 174.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.8 pm0 -61.62 -24.44 66.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.604 178.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.35 -34.41 31.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.727 0.299 . . . . 0.0 111.092 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 143.48 -160.03 27.6 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.115 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_exo -71.92 97.55 0.83 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.207 2.604 . . . . 0.0 111.463 175.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.736 HG21 ' HG1' ' A' ' 85' ' ' THR . 0.0 OUTLIER -113.01 -174.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.899 -175.722 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.418 ' SG ' ' HE1' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -67.69 127.66 33.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.084 0.469 . . . . 0.0 110.832 -177.793 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.609 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 6.5 tptp -73.53 -36.73 65.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.622 -178.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -144.37 -78.53 0.2 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -170.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.69 ' HB ' ' HB2' ' A' ' 35' ' ' CYS . 4.6 mt -110.92 136.18 47.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.404 -170.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 13.2 m -101.76 139.65 22.36 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 120.738 0.304 . . . . 0.0 110.853 177.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.519 ' HB1' ' HA ' ' A' ' 107' ' ' ALA . . . -155.24 166.92 32.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.134 0.492 . . . . 0.0 111.81 -178.52 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.5 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.8 m -113.2 117.71 32.65 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 173.468 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.685 ' O ' ' HA ' ' A' ' 31' ' ' SER . 39.8 t -123.6 124.46 26.21 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.504 -175.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -84.26 127.9 4.06 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.815 2.343 . . . . 0.0 113.028 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.437 ' CD ' ' HZ3' ' A' ' 69' ' ' LYS . 0.7 OUTLIER -73.33 105.37 4.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.042 0.448 . . . . 0.0 110.519 175.074 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.482 ' C ' ' HG1' ' A' ' 102' ' ' THR . . . 169.54 -80.44 0.1 OUTLIER Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 176.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.482 ' HG1' ' C ' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -160.51 161.32 32.74 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 122.728 0.411 . . . . 0.0 109.892 176.724 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.556 HG22 ' H ' ' A' ' 104' ' ' ASN . 23.7 m 79.76 150.66 0.11 Allowed 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.779 0.674 . . . . 0.0 110.733 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.572 ' HA ' ' CB ' ' A' ' 57' ' ' ASN . 0.3 OUTLIER -71.28 173.9 7.15 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -168.679 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.576 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.15 142.83 44.13 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.496 -177.624 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -99.16 127.91 51.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 121.061 0.458 . . . . 0.0 110.031 -177.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.519 ' HA ' ' HB1' ' A' ' 96' ' ' ALA . . . -94.48 136.01 35.27 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.818 177.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.71 -0.99 9.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.275 0.559 . . . . 0.0 111.271 -178.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.429 ' HB3' HG21 ' A' ' 94' ' ' ILE . 17.7 t0 -86.88 77.96 9.14 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.283 -179.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -138.53 -15.57 1.22 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.477 172.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -100.04 -1.7 36.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.005 176.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 104.96 93.77 2.32 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.738 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -92.76 -158.29 0.59 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 174.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -137.15 163.75 25.34 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.46 -0.876 . . . . 0.0 111.977 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.54 -62.19 1.5 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.351 0.596 . . . . 0.0 110.112 177.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.64 ' HB2' ' HB1' ' A' ' 17' ' ' ALA . 0.0 OUTLIER -157.27 6.55 0.15 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.199 176.387 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -115.13 92.24 3.87 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.311 -174.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 . . . . . 0 C--O 1.251 1.144 0 CA-C-O 117.655 -1.164 . . . . 0.0 108.867 175.473 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.476 0.84 0 CA-C-O 120.738 0.304 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.455 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.2 OUTLIER -128.29 116.74 20.09 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-O 120.731 0.3 . . . . 0.0 110.725 -177.845 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 2' ' ' LEU . 4.4 Cg_exo -76.74 140.46 20.89 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.047 2.498 . . . . 0.0 111.304 176.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.403 ' HB3' ' H ' ' A' ' 5' ' ' SER . . . -149.59 -104.34 0.07 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.719 0.295 . . . . 0.0 110.564 -177.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.403 ' H ' ' HB3' ' A' ' 4' ' ' ALA . 0.0 OUTLIER -74.2 -20.95 60.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.198 0.523 . . . . 0.0 110.415 178.074 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -130.34 173.12 11.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.101 178.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 63.13 50.5 3.04 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.94 0.775 . . . . 0.0 111.227 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.41 37.77 2.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.946 -179.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -78.1 72.63 4.64 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.02 -178.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -87.73 -30.57 20.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.612 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -100.46 148.7 24.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.776 0.322 . . . . 0.0 110.478 -178.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.709 HD11 ' HB3' ' A' ' 70' ' ' ALA . 7.9 mp -77.78 63.28 2.81 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.936 179.416 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 70.68 -24.98 0.16 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.808 0.843 . . . . 0.0 111.393 -178.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.551 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -170.57 -42.57 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.3 m 64.69 -74.45 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.416 -177.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.643 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . 52.99 -91.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.052 0.541 . . . . 0.0 111.307 -177.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.817 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . . . -63.15 -32.18 73.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.804 0.335 . . . . 0.0 110.526 177.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.52 ' HE2' ' SG ' ' A' ' 34' ' ' CYS . 28.5 t80 -68.71 -32.66 72.61 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.158 0.504 . . . . 0.0 110.05 176.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.34 -37.04 80.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.587 177.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.817 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 23.1 mttt -64.9 -36.96 86.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.38 0.609 . . . . 0.0 109.403 174.616 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -59.99 -40.87 90.63 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.309 174.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.21 -16.64 61.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.467 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.56 -40.44 11.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.658 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -75.83 -27.88 61.91 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.757 -177.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -114.33 146.23 40.78 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.586 0.231 . . . . 0.0 110.393 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.55 92.93 9.07 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 121.398 0.618 . . . . 0.0 111.208 -178.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.541 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -160.3 131.23 5.64 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 170.469 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -111.36 -175.15 2.63 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.517 -174.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.7 t -58.34 117.07 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.174 0.511 . . . . 0.0 109.849 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.488 ' O ' ' HA ' ' A' ' 99' ' ' PRO . . . 113.82 -23.68 12.87 Favored Glycine 0 N--CA 1.441 -1.001 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 -174.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.96 4.4 5.35 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.81 0.338 . . . . 0.0 111.2 178.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.447 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 5.3 tt -96.79 129.52 46.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.887 0.375 . . . . 0.0 110.807 -177.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.75 172.81 15.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.223 0.535 . . . . 0.0 111.929 -176.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.553 ' HB2' HD11 ' A' ' 81' ' ' LEU . 55.9 m -124.54 142.09 51.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.741 170.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -117.2 145.02 44.15 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.706 ' HB2' ' HB3' ' A' ' 81' ' ' LEU . 13.2 t-20 -131.6 159.74 37.37 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.942 0.401 . . . . 0.0 111.031 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -54.5 142.06 52.33 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.612 175.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.541 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 11.5 Cg_endo -55.39 -38.54 93.8 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 123.107 2.538 . . . . 0.0 112.795 -175.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.37 -16.69 64.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.963 0.411 . . . . 0.0 111.937 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -102.81 -42.68 5.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.526 179.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.66 -25.81 65.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.054 0.454 . . . . 0.0 110.841 178.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.541 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -104.84 14.29 29.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.4 179.499 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -62.32 -26.01 68.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.013 -175.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 1.026 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 14.6 t70 -122.03 150.85 41.51 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.588 0.232 . . . . 0.0 110.394 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.98 -35.03 79.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.216 -179.037 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.477 HD22 HD12 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -92.32 -15.99 26.64 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.464 179.851 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 1.026 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 5.0 tp -60.98 -40.94 95.35 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.085 -178.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -29.84 69.91 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.12 -177.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -84.59 -29.84 28.66 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.726 -0.749 . . . . 0.0 111.754 177.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.477 HD12 HD22 ' A' ' 46' ' ' LEU . 0.3 OUTLIER -68.53 -20.81 64.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.919 0.39 . . . . 0.0 110.972 179.275 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.763 HD13 HD22 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -56.57 -30.99 63.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.236 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.576 ' HA3' ' HB2' ' A' ' 56' ' ' LEU . . . -137.24 100.07 0.31 Allowed Glycine 0 N--CA 1.441 -1.031 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.033 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.525 ' HB3' HD12 ' A' ' 72' ' ' LEU . . . -75.1 55.14 0.72 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.107 0.479 . . . . 0.0 110.481 177.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 164.61 -118.08 0.79 Allowed Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.556 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.538 ' O ' HG23 ' A' ' 102' ' ' THR . 4.5 mp -120.02 52.89 1.1 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.933 0.397 . . . . 0.0 110.199 -177.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.576 ' HB2' ' HA3' ' A' ' 52' ' ' GLY . 0.3 OUTLIER -88.36 166.9 13.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.269 0.557 . . . . 0.0 111.828 -175.816 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.417 ' HB3' ' O ' ' A' ' 103' ' ' THR . 45.7 t30 -132.83 -179.13 5.29 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.384 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -101.64 -153.56 25.74 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.502 -0.856 . . . . 0.0 112.684 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.839 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 9.5 tp -67.38 143.47 56.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.561 0.22 . . . . 0.0 110.842 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.1 m -59.34 94.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.524 -179.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.62 -13.86 63.67 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.6 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.839 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 6.7 t-20 -99.72 92.22 5.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.021 0.439 . . . . 0.0 110.934 -177.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -76.14 72.22 2.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.049 176.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -179.46 -48.13 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.34 130.84 37.14 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.702 0.287 . . . . 0.0 110.397 176.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.717 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . . . -117.02 164.58 14.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.204 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.437 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 0.2 OUTLIER -129.36 127.96 42.11 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 120.822 0.344 . . . . 0.0 110.169 -178.46 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.49 ' CB ' HD12 ' A' ' 81' ' ' LEU . . . -109.43 148.82 30.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.983 178.07 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 32' ' ' ILE . 1.5 mppt? -92.46 168.25 11.4 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.614 -175.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.709 ' HB3' HD11 ' A' ' 12' ' ' LEU . . . -61.15 -32.62 72.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.197 -179.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.11 -48.6 77.84 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 176.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.525 HD12 ' HB3' ' A' ' 53' ' ' ALA . 0.1 OUTLIER -57.78 -40.45 79.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.786 177.172 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.914 ' HA ' ' HB2' ' A' ' 78' ' ' LEU . 11.4 mt -60.73 -47.82 91.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.63 179.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.95 -30.64 70.83 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.1 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.553 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -62.58 -53.82 48.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.538 -171.231 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.553 HD11 ' HB3' ' A' ' 75' ' ' GLN . 0.5 OUTLIER -138.67 25.53 2.59 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -171.247 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.502 ' O ' ' HG ' ' A' ' 79' ' ' LEU . . . 67.27 51.24 39.34 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 119.774 -1.203 . . . . 0.0 111.5 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.914 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 0.1 OUTLIER -73.53 72.57 1.4 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -174.227 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.781 ' HA ' ' HB ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -87.85 20.93 2.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.84 0.352 . . . . 0.0 110.905 178.092 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.1 -27.56 68.84 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.265 0.555 . . . . 0.0 110.558 179.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.763 HD22 HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -132.52 13.09 4.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.123 179.502 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.781 ' HB ' ' HA ' ' A' ' 79' ' ' LEU . 53.8 t -115.36 137.3 49.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.615 -173.175 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.403 ' N ' HG11 ' A' ' 82' ' ' VAL . 10.4 t70 -118.99 148.95 42.43 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 175.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 30.7 t-80 -109.87 115.49 29.91 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.089 -0.645 . . . . 0.0 111.65 -176.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.492 ' HB ' ' OE2' ' A' ' 87' ' ' GLU . 6.4 p -108.29 -173.92 2.39 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.466 174.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.47 -27.19 65.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.058 0.456 . . . . 0.0 110.051 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.643 ' HB3' ' HB3' ' A' ' 16' ' ' ALA . 1.9 mp0 -68.33 -24.39 64.82 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.015 176.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 129.47 -158.54 22.17 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.418 178.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -73.79 120.21 6.29 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 123.188 2.592 . . . . 0.0 111.53 176.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.529 ' HB ' ' HE2' ' A' ' 116' ' ' LYS . 0.4 OUTLIER -137.56 166.86 23.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.282 -175.878 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 9.0 m -67.09 139.02 57.54 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.217 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.9 tttp -75.93 -49.85 16.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.643 -175.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -129.9 -86.0 0.53 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -170.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 5.6 mt -85.52 132.73 31.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.036 -168.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -94.5 123.79 46.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.386 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.437 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . . . -153.33 151.73 30.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.527 -178.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.541 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 3.7 m -105.45 123.59 48.14 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.281 0.562 . . . . 0.0 109.699 178.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 26.6 t -130.31 128.57 22.71 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.983 -172.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.488 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 10.5 Cg_exo -70.91 141.41 40.51 Favored 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.786 2.324 . . . . 0.0 112.275 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -88.2 103.99 16.29 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 171.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.497 ' H ' HD11 ' A' ' 56' ' ' LEU . . . 165.09 -78.65 0.13 Allowed Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.538 HG23 ' O ' ' A' ' 55' ' ' LEU . 0.3 OUTLIER -155.33 -174.81 5.13 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.54 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.417 ' O ' ' HB3' ' A' ' 57' ' ' ASN . 23.8 p 62.99 178.22 0.15 Allowed 'General case' 0 C--O 1.235 0.302 0 O-C-N 124.177 0.923 . . . . 0.0 112.449 178.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -93.02 173.96 7.47 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.721 -168.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.502 ' O ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -112.72 143.01 44.67 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.446 -176.308 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -87.46 141.82 13.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.917 0.389 . . . . 0.0 110.46 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -105.18 124.34 49.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.97 0.414 . . . . 0.0 110.902 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.406 ' H ' HG23 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -101.39 18.71 3.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.504 0.669 . . . . 0.0 109.828 178.891 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -76.65 70.3 3.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.208 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -135.6 20.52 3.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.779 -179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -113.04 166.4 11.45 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.354 -174.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -122.51 42.24 1.67 Allowed Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.947 -0.644 . . . . 0.0 111.529 179.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -103.73 -167.7 1.41 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.941 0.4 . . . . 0.0 110.753 -177.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -82.26 161.15 40.96 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.697 -0.763 . . . . 0.0 111.324 175.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.27 -56.31 23.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.15 0.5 . . . . 0.0 110.835 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.529 ' HE2' ' HB ' ' A' ' 90' ' ' VAL . 0.1 OUTLIER -168.04 24.42 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.688 175.909 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -103.36 79.14 1.68 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.409 -174.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.103 -0.951 . . . . 0.0 109.23 175.776 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -130.46 143.94 51.3 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.39 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -67.51 88.0 0.34 Allowed 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 122.625 2.217 . . . . 0.0 111.623 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.47 -48.67 68.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.891 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -148.52 -43.48 0.15 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.881 176.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -158.69 170.21 22.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.433 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -164.36 -68.19 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.66 177.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -163.51 44.47 0.11 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 176.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -90.02 114.74 26.67 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.949 -169.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 62.5 -169.92 0.18 Allowed 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.482 173.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.5 mttt 52.52 -143.44 0.7 Allowed 'General case' 0 C--N 1.338 0.092 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.752 -178.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.477 HD11 ' HB3' ' A' ' 70' ' ' ALA . 4.8 mp -96.1 51.3 1.22 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 177.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 54.04 67.09 1.06 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.607 -176.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 37.4 m 79.28 -37.74 0.19 Allowed 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.245 -178.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.592 ' HB3' ' HB3' ' A' ' 18' ' ' PHE . 0.9 OUTLIER 54.41 53.11 11.29 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.855 0.36 . . . . 0.0 111.689 174.748 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.16 -58.08 10.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.209 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.62 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . . . -73.84 -16.96 61.12 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.249 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.592 ' HB3' ' HB3' ' A' ' 15' ' ' SER . 80.3 t80 -79.51 -35.75 39.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.863 0.364 . . . . 0.0 110.474 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.88 -30.43 71.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.862 0.363 . . . . 0.0 110.796 176.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.62 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 46.4 mttt -69.29 -20.47 63.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.399 0.618 . . . . 0.0 109.711 176.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.92 -46.12 10.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.401 177.521 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.79 -18.43 64.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.892 -171.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.1 -21.0 60.83 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.669 -177.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -101.36 3.5 54.36 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.39 -0.91 . . . . 0.0 112.75 -178.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.407 HG23 ' HB ' ' A' ' 108' ' ' VAL . 0.0 OUTLIER -121.99 134.25 54.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.933 0.366 . . . . 0.0 111.815 -175.381 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.48 96.97 4.84 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.178 174.597 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.581 ' SG ' ' HA ' ' A' ' 32' ' ' ILE . 0.5 OUTLIER -150.67 172.61 15.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.507 -179.289 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -123.85 159.39 29.71 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.739 -0.21 . . . . 0.0 110.589 -173.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 p -65.72 120.05 11.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.451 0.643 . . . . 0.0 110.144 178.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.84 -38.89 2.92 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.453 -175.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.98 -1.62 57.8 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.032 0.444 . . . . 0.0 110.925 178.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.581 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 2.0 tt -80.25 134.47 27.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.63 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -144.14 173.03 12.09 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.877 0.846 . . . . 0.0 113.115 -167.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 28.4 t -122.4 133.49 54.63 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.295 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.415 ' HB2' ' HB1' ' A' ' 96' ' ' ALA . 1.3 t -117.47 157.58 26.0 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.942 ' HB2' HD21 ' A' ' 81' ' ' LEU . 8.7 t-20 -149.07 159.33 44.33 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.743 -175.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.82 135.62 55.98 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.641 174.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.703 ' HG3' ' HG ' ' A' ' 65' ' ' SER . 74.5 Cg_exo -47.29 -46.76 18.94 Favored 'Trans proline' 0 C--O 1.22 -0.388 0 C-N-CA 123.576 2.851 . . . . 0.0 113.834 -172.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.546 ' HA ' ' ND2' ' A' ' 42' ' ' ASN . . . -60.93 -9.41 4.17 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -173.628 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.575 ' O ' ' HB2' ' A' ' 43' ' ' ASN . 4.6 tt0 -112.49 -41.36 3.88 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.68 HG22 HD12 ' A' ' 81' ' ' LEU . 2.5 m -59.28 -42.89 92.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.957 0.884 . . . . 0.0 110.584 171.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.546 ' ND2' ' HA ' ' A' ' 39' ' ' ALA . 0.0 OUTLIER -87.8 11.06 16.45 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.885 -175.243 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.575 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 1.8 t-20 -51.55 -34.8 38.13 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.968 -174.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 1.033 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 28.5 t70 -116.13 147.38 41.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.872 0.368 . . . . 0.0 110.997 178.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -40.52 97.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.134 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.28 -29.05 26.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.752 0.311 . . . . 0.0 110.319 -178.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 1.033 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -55.12 -32.94 62.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.574 173.346 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.84 -9.8 32.23 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.443 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -116.52 -8.89 11.99 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 172.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 1.2 tp -84.06 -19.99 33.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.976 0.417 . . . . 0.0 110.964 -176.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.406 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -67.24 -21.61 65.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.415 -179.091 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.13 91.77 0.28 Allowed Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.457 ' H ' HD22 ' A' ' 72' ' ' LEU . . . -58.49 -30.75 67.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.767 0.318 . . . . 0.0 111.757 -174.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -96.14 29.73 9.65 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.694 -179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.0 mt 61.59 54.95 2.88 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.4 0.619 . . . . 0.0 109.8 -175.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 103' ' ' THR . 0.5 OUTLIER -80.89 -161.97 0.44 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.229 -176.498 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.443 ' H ' ' CG ' ' A' ' 56' ' ' LEU . 7.9 t-20 -133.03 -177.17 4.39 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.234 -174.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.675 ' HA2' ' HB3' ' A' ' 66' ' ' ALA . . . -95.52 -144.2 16.24 Favored Glycine 0 C--N 1.314 -0.645 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -176.174 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.776 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -66.59 155.03 38.94 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 175.074 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.455 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 1.6 t -61.33 100.49 0.13 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.013 0.435 . . . . 0.0 111.322 -178.077 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.01 -0.4 69.25 Favored Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.142 -179.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.776 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 24.1 t-20 -128.95 97.04 4.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.109 0.481 . . . . 0.0 110.257 -176.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.06 71.09 10.26 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.334 0.588 . . . . 0.0 111.072 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -167.23 -50.92 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.134 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.703 ' HG ' ' HG3' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -89.75 79.87 6.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.139 0.495 . . . . 0.0 109.862 174.312 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.675 ' HB3' ' HA2' ' A' ' 58' ' ' GLY . . . -86.7 164.19 16.9 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.199 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.787 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -131.86 153.03 50.62 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.578 -179.028 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.629 ' HB1' HD13 ' A' ' 81' ' ' LEU . . . -116.67 138.74 51.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.244 -178.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.796 ' HE3' HD21 ' A' ' 72' ' ' LEU . 0.0 OUTLIER -88.28 165.45 15.01 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.962 -177.083 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.477 ' HB3' HD11 ' A' ' 12' ' ' LEU . . . -62.33 -25.31 67.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.108 0.48 . . . . 0.0 110.96 -179.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -32.39 70.24 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.441 0.639 . . . . 0.0 109.577 177.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.796 HD21 ' HE3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -73.9 -30.82 62.8 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.574 178.992 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.5 mt -67.87 -35.68 73.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.597 176.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -74.8 -31.43 61.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.933 177.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.08 -52.83 6.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.824 -176.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.52 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 2.8 mm? -105.64 -45.81 4.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.443 -173.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.54 49.59 5.1 Favored Glycine 0 CA--C 1.518 0.279 0 C-N-CA 119.994 -1.098 . . . . 0.0 112.533 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.502 ' H ' ' HG ' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -77.59 106.68 9.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.893 0.378 . . . . 0.0 110.978 -179.239 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.527 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -66.87 -18.29 65.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.938 -177.909 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.73 -21.65 64.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.809 0.337 . . . . 0.0 111.357 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.942 HD21 ' HB2' ' A' ' 36' ' ' ASN . 1.9 mt -123.45 28.6 6.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.291 0.567 . . . . 0.0 111.298 -176.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 2.0 p -142.44 145.41 23.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.313 176.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.595 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 9.8 t70 -122.88 171.09 9.47 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.05 177.456 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.31 80.29 1.79 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.143 0.497 . . . . 0.0 111.223 -174.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.6 t -78.86 171.81 14.65 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 172.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -51.4 -38.98 56.23 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -176.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -88.91 48.35 1.62 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.0 0.429 . . . . 0.0 111.886 -176.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.44 -175.78 49.56 Favored Glycine 0 CA--C 1.522 0.482 0 CA-C-N 115.82 -0.627 . . . . 0.0 113.993 172.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -62.96 138.09 66.14 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.985 2.456 . . . . 0.0 111.547 175.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.445 HG12 ' HB1' ' A' ' 17' ' ' ALA . 0.3 OUTLIER -149.51 173.43 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.152 -172.815 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 14.1 t -67.64 143.3 56.07 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 174.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.595 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 2.8 tttp -78.24 -46.3 20.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.38 -176.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.492 ' HB3' HG13 ' A' ' 94' ' ' ILE . 4.5 m-20 -142.89 -82.14 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.029 0.442 . . . . 0.0 111.948 -172.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.492 HG13 ' HB3' ' A' ' 93' ' ' ASN . 2.1 mt -96.65 130.31 45.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.237 -170.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.3 p -83.42 138.06 19.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.668 0.27 . . . . 0.0 110.371 176.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.49 ' HA ' HG21 ' A' ' 108' ' ' VAL . . . -148.68 164.18 35.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.017 0.437 . . . . 0.0 111.926 -175.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.55 122.28 46.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.314 175.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.787 ' SG ' ' HB2' ' A' ' 67' ' ' CYS . 57.0 m -132.71 127.58 20.49 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.516 -173.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -86.89 178.11 3.8 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.118 1.879 . . . . 0.0 110.965 173.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.431 ' HA ' HD11 ' A' ' 56' ' ' LEU . 1.0 OUTLIER -123.94 157.52 34.12 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 168.99 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 102.26 -45.15 1.4 Allowed Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.865 -178.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.714 HG21 ' HG1' ' A' ' 103' ' ' THR . 10.5 t -177.92 174.97 1.36 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.714 ' HG1' HG21 ' A' ' 102' ' ' THR . 0.6 OUTLIER 68.52 -175.11 0.2 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.594 176.672 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.672 ' H ' HG23 ' A' ' 103' ' ' THR . 0.3 OUTLIER -104.91 -178.9 3.79 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.079 -164.016 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 68.6 m -112.52 143.48 43.6 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.858 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 86.9 t -103.71 113.33 40.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.176 175.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.98 118.32 18.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 174.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.49 HG21 ' HA ' ' A' ' 96' ' ' ALA . 0.1 OUTLIER -96.05 17.61 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.806 -170.575 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -115.73 106.34 13.76 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.556 0.693 . . . . 0.0 110.191 174.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -128.56 30.9 5.07 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 114.869 -1.06 . . . . 0.0 108.619 173.13 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -128.45 -39.54 1.67 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.882 -177.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 96.74 86.79 1.8 Allowed Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.359 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -86.84 -151.81 0.17 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.888 0.375 . . . . 0.0 111.008 177.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -102.0 -115.29 3.96 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.642 -0.79 . . . . 0.0 111.557 175.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.539 ' O ' ' HG3' ' A' ' 116' ' ' LYS . 1.7 p -104.64 -36.14 7.57 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 173.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.539 ' HG3' ' O ' ' A' ' 115' ' ' THR . 2.0 mtmm -158.02 -83.77 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.563 -1.199 . . . . 0.0 108.683 175.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -120.49 78.44 1.37 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 173.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 . . . . . 0 C--O 1.253 1.286 0 CA-C-O 117.774 -1.108 . . . . 0.0 109.973 -177.389 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.775 0 CA-C-O 120.432 0.158 . . . . 0.0 110.613 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.5 145.25 98.94 Favored Pre-proline 0 C--O 1.233 0.211 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.543 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -75.04 64.46 6.08 Favored 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 122.722 2.281 . . . . 0.0 112.693 -178.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.48 -55.72 4.84 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.172 0.511 . . . . 0.0 110.158 178.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.3 -0.39 46.65 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.301 176.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 72.95 -45.63 0.63 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.303 177.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 60.97 47.74 7.2 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.438 0.637 . . . . 0.0 110.684 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.8 mttt -128.17 112.86 14.99 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.042 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.38 -171.9 2.04 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.68 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -98.76 16.11 23.22 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.739 -175.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.9 mtmt -110.27 102.45 11.11 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.425 ' C ' ' H ' ' A' ' 14' ' ' THR . 0.0 OUTLIER -73.41 86.36 1.52 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.24 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 74.76 -44.47 0.55 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.212 -172.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.432 ' O ' ' HB2' ' A' ' 15' ' ' SER . 0.5 OUTLIER -158.44 -40.16 0.06 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.79 -177.961 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' THR . 2.7 m 69.75 -69.32 0.17 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.513 -177.299 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 47.26 -92.58 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.475 0.71 . . . . 0.0 112.154 178.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.508 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . . . -62.9 -30.53 71.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.191 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -67.12 -27.6 67.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 110.305 177.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.87 -20.85 60.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.539 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.508 ' HD3' ' HA ' ' A' ' 17' ' ' ALA . 5.0 mtpp -71.83 -26.84 62.54 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.556 ' HG3' ' HA ' ' A' ' 116' ' ' LYS . 0.0 OUTLIER -86.34 -36.57 19.16 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 113.893 -1.503 . . . . 0.0 110.541 179.29 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.67 -14.0 61.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.055 -174.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -109.15 16.77 22.25 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.445 0.641 . . . . 0.0 110.442 175.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -115.86 -27.67 2.92 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.22 174.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.572 HG21 HG21 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -103.67 142.22 34.71 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.607 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -91.12 96.7 10.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.932 0.396 . . . . 0.0 110.741 178.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 81.6 m -148.92 -179.04 6.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -98.73 159.87 14.66 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.457 ' H ' HG22 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -64.12 -49.48 81.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 120.798 0.332 . . . . 0.0 111.581 -178.113 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.21 -27.67 57.46 Favored Glycine 0 CA--C 1.509 -0.3 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.803 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -100.77 46.17 0.95 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.717 0.294 . . . . 0.0 111.218 -175.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.3 tt -112.32 138.84 39.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 174.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.709 ' HB2' ' HB3' ' A' ' 67' ' ' CYS . . . -146.54 155.32 42.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.536 0.684 . . . . 0.0 112.626 -171.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.6 m -109.88 133.23 53.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.637 174.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.402 ' SG ' ' HB1' ' A' ' 96' ' ' ALA . 0.0 OUTLIER -123.13 165.13 17.36 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.6 -178.387 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.521 ' N ' HD22 ' A' ' 81' ' ' LEU . 3.2 t30 -149.29 161.16 42.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.71 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -49.02 127.36 14.73 Favored Pre-proline 0 C--O 1.237 0.398 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.572 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.454 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 31.4 Cg_exo -47.93 -47.45 18.93 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 123.815 3.01 . . . . 0.0 113.925 -178.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.51 -20.58 56.49 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -173.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -102.91 -48.57 4.03 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.033 0.444 . . . . 0.0 109.839 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.703 HG21 HD23 ' A' ' 81' ' ' LEU . 88.1 m -59.31 -35.95 74.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.564 177.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.454 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.4 m-80 -103.88 14.69 30.29 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.316 -173.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -69.08 -21.64 64.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.217 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.928 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.0 t70 -103.66 152.76 21.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.495 179.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.91 -29.41 44.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.743 0.306 . . . . 0.0 111.441 -177.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.477 HD21 HD12 ' A' ' 50' ' ' LEU . 9.6 tp -90.03 -36.98 14.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.698 0.285 . . . . 0.0 110.493 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.928 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.4 OUTLIER -50.47 -38.69 45.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.67 178.058 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -28.18 69.64 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.573 -176.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -95.31 -25.1 14.66 Favored Glycine 0 C--N 1.33 0.207 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.626 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.477 HD12 HD21 ' A' ' 46' ' ' LEU . 1.2 tp -63.64 -32.89 74.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.969 0.414 . . . . 0.0 110.623 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.561 ' HA ' HD13 ' A' ' 78' ' ' LEU . 7.6 mt -60.53 -39.89 89.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.631 177.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.673 ' HA2' ' HG ' ' A' ' 56' ' ' LEU . . . -87.08 67.6 3.34 Favored Glycine 0 N--CA 1.443 -0.865 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.625 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -68.5 -23.85 64.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.435 0.636 . . . . 0.0 110.437 -176.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -124.55 25.66 5.89 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.046 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 63.74 39.26 8.65 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.471 0.653 . . . . 0.0 109.86 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.673 ' HG ' ' HA2' ' A' ' 52' ' ' GLY . 0.7 OUTLIER -80.32 179.66 7.57 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.038 177.392 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.928 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 7.9 t-20 -118.75 -177.27 3.27 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.37 -175.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -97.93 -143.06 14.1 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.453 -176.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.75 HD11 ' HB2' ' A' ' 107' ' ' ALA . 0.2 OUTLIER -65.54 148.89 50.97 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 178.957 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.583 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -57.24 90.28 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.64 -178.684 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.78 -10.34 70.54 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.86 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.522 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 57.9 t30 -117.55 105.93 12.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.284 0.564 . . . . 0.0 111.72 -174.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.44 131.5 42.65 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.359 178.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.48 -56.44 0.73 Allowed Glycine 0 CA--C 1.509 -0.325 0 C-N-CA 121.1 -0.571 . . . . 0.0 111.954 177.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.2 90.97 4.92 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.97 0.414 . . . . 0.0 110.42 178.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.02 160.74 16.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.079 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.709 ' HB3' ' HB2' ' A' ' 33' ' ' ALA . 64.7 m -126.55 130.84 51.34 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.061 0.457 . . . . 0.0 110.994 -178.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.626 ' HB2' ' CD1' ' A' ' 81' ' ' LEU . . . -105.49 125.83 51.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.578 178.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.437 ' NZ ' ' HA ' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -82.66 167.47 18.22 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.771 -178.555 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.506 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -60.55 -30.28 69.68 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.301 0.572 . . . . 0.0 109.997 175.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -23.12 63.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.511 176.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.801 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 1.3 tp -87.65 -24.03 24.05 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.501 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.506 HD12 ' HA ' ' A' ' 70' ' ' ALA . 0.5 OUTLIER -60.29 -38.01 75.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.152 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -90.52 -5.11 56.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.408 0.623 . . . . 0.0 110.704 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.801 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -87.38 -54.16 4.44 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.138 -176.798 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.592 HD21 ' HB2' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -126.73 -9.91 6.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.509 -176.495 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 67.33 47.93 60.92 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.407 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.561 HD13 ' HA ' ' A' ' 51' ' ' LEU . 65.6 mt -71.19 129.91 40.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.653 0.263 . . . . 0.0 111.264 -178.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.63 4.16 19.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.093 177.09 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.49 -29.56 62.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.098 -174.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.703 HD23 HG21 ' A' ' 41' ' ' THR . 0.0 OUTLIER -128.89 4.92 5.4 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.973 0.416 . . . . 0.0 111.355 -174.666 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 6.2 t -111.11 137.66 42.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.885 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.898 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 6.9 t0 -115.47 154.61 28.99 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.7 m80 -125.87 114.6 18.76 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.316 0.579 . . . . 0.0 110.179 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.07 -169.96 1.56 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.143 -177.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -72.63 -19.75 61.39 Favored 'General case' 0 C--N 1.323 -0.57 0 O-C-N 123.335 0.397 . . . . 0.0 111.0 -178.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -89.14 -14.05 37.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.01 177.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 128.85 -152.79 19.47 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.516 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -79.51 129.59 8.49 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 123.321 2.68 . . . . 0.0 111.91 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.792 HG21 ' HE2' ' A' ' 116' ' ' LYS . 3.1 m -149.55 -178.56 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.237 -175.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.92 133.7 43.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.237 177.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.898 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 8.1 tttp -74.98 -49.92 18.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.545 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -136.84 -74.91 0.42 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.149 -172.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.0 mt -98.93 138.63 22.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.602 -171.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.4 p -112.27 138.93 39.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.474 ' CB ' ' HA ' ' A' ' 107' ' ' ALA . . . -150.2 168.93 22.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.05 0.452 . . . . 0.0 111.867 -176.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -112.03 117.17 31.95 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 171.944 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.507 ' HA ' ' HB3' ' A' ' 105' ' ' CYS . 44.5 t -138.69 139.76 25.31 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.673 0.273 . . . . 0.0 111.735 -170.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -82.86 -178.42 3.88 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 123.35 2.7 . . . . 0.0 112.093 176.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.437 ' HA ' ' NZ ' ' A' ' 69' ' ' LYS . 3.2 tp10 -80.18 -30.63 38.82 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -177.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.57 ' HA2' ' HA ' ' A' ' 56' ' ' LEU . . . -178.82 64.56 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 119.532 -1.318 . . . . 0.0 113.202 -178.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -153.94 108.54 3.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.601 0.239 . . . . 0.0 110.471 175.084 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 54.61 -176.25 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.669 0.747 . . . . 0.0 112.52 -178.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.928 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -74.42 165.44 25.19 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.734 -178.009 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.507 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 2.5 m -111.03 143.16 42.16 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.002 -175.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.0 p -85.35 120.79 36.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.125 0.488 . . . . 0.0 111.254 -176.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.75 ' HB2' HD11 ' A' ' 59' ' ' LEU . . . -96.88 125.76 41.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.144 175.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.572 HG21 HG21 ' A' ' 25' ' ' THR . 0.1 OUTLIER -89.38 10.52 2.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.109 0.48 . . . . 0.0 110.945 -178.173 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.501 ' O ' ' HB3' ' A' ' 110' ' ' ASN . 21.2 t0 -74.39 139.22 43.9 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.306 179.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.501 ' HB3' ' O ' ' A' ' 109' ' ' ASP . 3.9 p30 168.13 -14.47 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.301 1.001 . . . . 0.0 109.306 -176.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -71.36 -44.57 64.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.414 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 112.7 114.19 3.27 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.478 -0.868 . . . . 0.0 112.492 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . 62.27 53.14 2.91 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.256 0.551 . . . . 0.0 111.139 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -109.07 65.9 0.24 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.417 -0.897 . . . . 0.0 113.234 -177.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.424 ' H ' HG23 ' A' ' 115' ' ' THR . 0.1 OUTLIER -87.45 -44.34 11.4 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 176.976 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.792 ' HE2' HG21 ' A' ' 90' ' ' VAL . 7.4 mtmt -151.52 147.49 26.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.56 178.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -79.65 121.84 25.8 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 173.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.77 -0.633 . . . . 0.0 110.881 -176.784 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -126.78 144.91 51.65 Favored Pre-proline 0 C--N 1.327 -0.395 0 O-C-N 122.309 -0.244 . . . . 0.0 110.764 -177.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -66.06 -17.06 54.49 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 122.565 2.177 . . . . 0.0 112.466 177.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 59.27 34.4 23.0 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.929 175.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 29.5 m 69.95 7.3 6.16 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 178.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.04 -63.65 1.06 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 176.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -80.03 124.38 28.67 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 170.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.4 43.31 2.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.133 0.492 . . . . 0.0 110.833 -174.588 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -136.83 135.67 38.14 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.742 179.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -139.78 50.13 1.76 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.013 0.435 . . . . 0.0 110.705 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -119.72 177.8 4.82 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.7 177.362 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.678 ' N ' HD21 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -80.66 57.79 3.06 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 173.325 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.464 ' HB2' ' O ' ' A' ' 12' ' ' LEU . . . 70.88 -53.42 0.67 Allowed 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.59 0.756 . . . . 0.0 109.752 -167.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.447 ' C ' ' HG ' ' A' ' 15' ' ' SER . 0.0 OUTLIER -149.61 -34.12 0.19 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.344 175.819 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.52 ' CB ' ' HB2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER 62.53 32.34 16.57 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.398 -0.819 . . . . 0.0 112.096 175.467 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.1 -37.92 84.76 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.136 0.493 . . . . 0.0 110.073 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.37 -33.63 19.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.552 177.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.607 ' CD2' ' HG ' ' A' ' 12' ' ' LEU . 87.7 t80 -69.66 -44.35 70.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.453 -177.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.44 0.67 0.66 Allowed 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.668 ' HB3' ' HB ' ' A' ' 115' ' ' THR . 0.0 OUTLIER -73.37 -5.89 42.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.623 0.725 . . . . 0.0 109.112 176.178 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.462 ' HA ' ' OG1' ' A' ' 25' ' ' THR . 0.0 OUTLIER -82.88 -8.82 59.54 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.377 176.97 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -109.11 3.76 22.29 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.757 175.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.466 ' OE1' ' HG3' ' A' ' 20' ' ' LYS . 41.6 mt-10 -115.68 -75.97 0.58 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.734 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.523 ' HA3' HG23 ' A' ' 115' ' ' THR . . . -70.07 -42.52 67.62 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.893 178.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.471 HG21 HG22 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -83.82 132.05 34.84 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.397 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.88 95.32 7.3 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.232 0.539 . . . . 0.0 110.681 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 60.7 m -144.56 -178.32 5.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.256 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -110.84 148.36 32.57 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.9 t -66.87 -47.43 82.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.912 0.387 . . . . 0.0 110.744 -177.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.73 18.51 5.81 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.322 177.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -152.42 38.0 0.54 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.107 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.501 HG22 ' HE2' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -96.57 136.56 27.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.087 -178.964 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.506 ' HB2' ' HB3' ' A' ' 98' ' ' CYS . . . -149.53 -179.72 7.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.18 0.514 . . . . 0.0 112.204 -175.001 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.548 ' SG ' ' HE1' ' A' ' 18' ' ' PHE . 64.8 m -131.81 144.82 51.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.814 175.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.404 ' HA ' ' HG ' ' A' ' 81' ' ' LEU . 0.9 OUTLIER -134.72 165.08 26.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.645 0.26 . . . . 0.0 110.568 -176.105 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.468 ' N ' HD12 ' A' ' 81' ' ' LEU . 33.7 t-20 -154.08 161.16 42.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.258 177.69 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.5 m -53.99 146.92 26.79 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.139 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.414 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 46.4 Cg_exo -56.58 -33.74 93.75 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 123.05 2.5 . . . . 0.0 113.004 -175.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.05 -14.87 63.32 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.61 -48.7 3.37 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.311 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.709 ' HA ' ' HB3' ' A' ' 80' ' ' ALA . 3.1 m -56.29 -36.28 68.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.468 178.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.8 m-80 -105.58 14.23 28.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.847 -174.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -62.53 -26.49 68.59 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.952 0.406 . . . . 0.0 111.178 -175.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.815 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 8.0 t70 -119.02 146.16 45.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.683 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -24.85 62.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.105 0.479 . . . . 0.0 111.122 -179.342 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.2 tp -90.83 -23.58 20.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.104 177.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.815 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.7 OUTLIER -60.01 -45.92 91.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.876 179.99 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.8 -32.87 74.64 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.931 -178.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -75.86 -22.3 74.78 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 121.011 -0.614 . . . . 0.0 111.778 176.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.727 ' HB3' HD13 ' A' ' 78' ' ' LEU . 0.7 OUTLIER -75.44 -26.17 58.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.038 0.447 . . . . 0.0 109.855 177.881 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.697 ' HG ' ' HB3' ' A' ' 66' ' ' ALA . 0.2 OUTLIER -67.33 -40.33 85.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.716 179.139 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.66 72.19 1.72 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.336 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.37 -17.04 61.86 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.165 0.507 . . . . 0.0 110.312 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.24 47.46 0.8 Allowed Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.619 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.9 mt 55.39 51.79 12.38 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.181 0.515 . . . . 0.0 110.743 -177.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.48 HD13 ' OE1' ' A' ' 100' ' ' GLU . 12.8 mt -88.84 172.27 9.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.887 -177.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.489 ' HB2' ' C ' ' A' ' 103' ' ' THR . 4.3 m-20 -114.59 -178.39 3.36 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.378 174.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -99.46 -131.88 7.49 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.346 -0.93 . . . . 0.0 111.025 178.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.802 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.3 OUTLIER -67.92 155.89 38.41 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 171.339 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.401 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -52.24 105.7 0.12 Allowed 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 120.84 0.352 . . . . 0.0 111.148 -178.128 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.14 33.26 85.27 Favored Glycine 0 C--N 1.335 0.506 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.414 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.802 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 25.1 t-20 -126.08 100.9 6.54 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.904 0.383 . . . . 0.0 110.399 -176.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.45 77.56 9.21 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.085 0.469 . . . . 0.0 111.105 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.07 -55.62 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.91 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.6 m -88.66 129.59 35.48 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 176.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.697 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . . . -131.82 153.96 49.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.592 0.234 . . . . 0.0 110.423 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.673 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 0.8 OUTLIER -118.09 135.55 54.13 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.272 0.558 . . . . 0.0 111.201 -174.343 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -105.71 146.52 29.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.294 177.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.502 ' HE3' ' HG2' ' A' ' 100' ' ' GLU . 1.6 mppt? -102.36 168.33 9.39 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.427 ' HB3' HD23 ' A' ' 12' ' ' LEU . . . -60.36 -36.14 77.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.019 0.437 . . . . 0.0 110.809 178.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.609 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -62.85 -27.7 69.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.517 176.861 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.539 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 4.0 mp -82.21 -25.55 34.1 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.709 -178.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.23 -36.68 77.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.045 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -100.05 4.08 44.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.767 177.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.609 ' HB2' ' O ' ' A' ' 71' ' ' SER . 1.0 OUTLIER -94.92 -53.89 3.67 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.114 -178.783 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.568 ' HB3' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -123.89 -30.98 3.46 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.964 -175.522 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.94 50.76 3.19 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.02 -1.086 . . . . 0.0 112.0 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.727 HD13 ' HB3' ' A' ' 50' ' ' LEU . 3.7 mm? -57.44 113.08 1.62 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.754 0.312 . . . . 0.0 110.976 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.27 6.32 48.57 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.189 -177.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.784 ' HB1' HD23 ' A' ' 47' ' ' LEU . . . -89.37 -40.84 12.48 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -175.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.655 HD11 HG23 ' A' ' 41' ' ' THR . 0.2 OUTLIER -99.21 -4.68 31.47 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.728 -171.749 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.514 HG21 ' O ' ' A' ' 78' ' ' LEU . 2.8 t -108.86 137.94 38.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.875 0.369 . . . . 0.0 111.023 -174.356 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.707 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 27.7 t0 -120.29 174.42 6.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.108 179.204 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 27.1 p80 -60.11 140.51 56.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.115 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.512 ' HB ' HG21 ' A' ' 90' ' ' VAL . 5.3 t -143.14 160.68 39.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.852 -177.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -115.29 16.18 16.85 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.436 0.636 . . . . 0.0 109.71 176.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -139.8 -93.48 0.17 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.42 179.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.62 160.35 17.1 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 175.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.483 ' O ' HD11 ' A' ' 12' ' ' LEU . 51.3 Cg_exo -52.21 128.84 28.8 Favored 'Trans proline' 0 N--CA 1.474 0.326 0 C-N-CA 122.791 2.328 . . . . 0.0 112.259 -176.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.512 HG21 ' HB ' ' A' ' 85' ' ' THR . 29.0 m -125.16 159.72 31.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.946 -175.234 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.4 m -66.84 142.52 57.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.066 0.46 . . . . 0.0 111.227 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.707 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 2.0 tttp -75.43 -37.92 60.1 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.692 -176.515 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 12.1 m-20 -146.63 -72.13 0.23 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.27 -0.423 . . . . 0.0 112.015 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 74.7 mt -86.87 126.68 40.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.566 -171.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 27.4 m -92.93 128.91 44.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.404 174.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.476 ' HB1' ' HA ' ' A' ' 107' ' ' ALA . . . -154.84 156.68 36.64 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.796 0.331 . . . . 0.0 111.097 -176.206 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.58 131.27 53.18 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 174.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.522 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 28.3 t -143.73 134.86 12.54 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.154 -172.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -85.26 155.8 10.97 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 122.488 2.126 . . . . 0.0 111.838 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.502 ' HG2' ' HE3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -100.55 127.63 46.86 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 176.221 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 100.41 -7.7 58.3 Favored Glycine 0 N--CA 1.44 -1.077 0 C-N-CA 120.745 -0.74 . . . . 0.0 113.379 176.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.76 121.15 10.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -172.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.489 ' C ' ' HB2' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 41.52 -135.11 0.28 Allowed 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.876 1.435 . . . . 0.0 114.876 168.708 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.451 ' H ' ' HB ' ' A' ' 103' ' ' THR . 0.3 OUTLIER -111.83 179.57 3.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.558 0.694 . . . . 0.0 112.599 -164.237 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.673 ' SG ' ' HB2' ' A' ' 67' ' ' CYS . 0.0 OUTLIER -118.47 154.98 31.6 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.735 -1.12 . . . . 0.0 111.052 -176.727 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.409 ' O ' HG21 ' A' ' 106' ' ' VAL . 2.3 m -103.76 137.92 30.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.348 178.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.476 ' HA ' ' HB1' ' A' ' 96' ' ' ALA . . . -104.57 142.04 35.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.087 -176.09 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.471 HG22 HG21 ' A' ' 25' ' ' THR . 0.0 OUTLIER -122.62 20.6 4.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.294 0.568 . . . . 0.0 111.21 -178.114 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -90.32 21.14 3.99 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.86 -178.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -77.36 -5.67 50.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.331 -178.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -135.32 170.85 15.3 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.228 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -84.1 62.37 4.59 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.004 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -140.12 92.38 2.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.056 0.455 . . . . 0.0 111.196 -178.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -132.89 116.04 1.69 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.615 -0.802 . . . . 0.0 111.869 178.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.668 ' HB ' ' HB3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -86.07 59.8 5.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.825 0.312 . . . . 0.0 111.223 -176.615 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.489 ' HZ3' ' HG3' ' A' ' 116' ' ' LYS . 0.0 OUTLIER -175.85 25.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.104 175.3 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . 0.45 ' O ' ' HB2' ' A' ' 118' ' ' GLU . . . -84.86 78.72 9.84 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.274 -177.409 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 117' ' ' ALA . 15.6 mt-10 . . . . . 0 C--O 1.25 1.11 0 O-C-N 124.041 0.838 . . . . 0.0 111.288 178.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.086 0 CA-C-O 120.966 0.412 . . . . 0.0 110.516 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.36 143.73 29.88 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 177.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -62.49 99.28 0.2 Allowed 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.676 2.251 . . . . 0.0 112.131 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.457 ' HB3' ' H ' ' A' ' 5' ' ' SER . . . -112.48 -128.01 0.29 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.031 177.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.457 ' H ' ' HB3' ' A' ' 4' ' ' ALA . 0.0 OUTLIER -86.2 -56.3 3.52 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.762 0.315 . . . . 0.0 110.512 177.193 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -156.75 172.26 18.92 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.225 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -108.1 161.12 15.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.953 0.406 . . . . 0.0 111.036 -178.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.5 107.6 13.44 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.889 -177.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -100.42 8.29 43.69 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.525 -177.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -87.17 -19.95 27.7 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.426 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.4 mmtp -132.5 145.22 51.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.923 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.599 ' HG ' ' OG ' ' A' ' 15' ' ' SER . 0.1 OUTLIER -104.3 90.59 3.6 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.097 178.162 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.435 ' O ' ' HB ' ' A' ' 14' ' ' THR . . . 60.69 60.4 1.93 Allowed 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.551 177.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.435 ' HB ' ' O ' ' A' ' 13' ' ' ALA . 87.5 m 76.68 -48.9 0.56 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.412 -178.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.651 ' HB3' ' HB3' ' A' ' 18' ' ' PHE . 20.2 m 57.29 41.25 26.97 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.141 0.276 . . . . 0.0 111.108 179.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.38 -50.14 70.49 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.771 0.319 . . . . 0.0 111.348 -173.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.443 ' HB3' ' HD2' ' A' ' 116' ' ' LYS . . . -93.61 -19.09 21.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.956 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.651 ' HB3' ' HB3' ' A' ' 15' ' ' SER . 19.9 t80 -70.13 -24.57 63.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.963 0.411 . . . . 0.0 110.089 177.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.96 -37.21 86.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.706 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.19 -33.4 71.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.519 0.676 . . . . 0.0 109.323 177.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.85 -39.05 80.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.475 176.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.43 -16.06 63.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.748 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -101.96 0.89 36.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.816 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.9 -32.43 63.65 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.913 -0.66 . . . . 0.0 111.94 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.04 158.89 44.07 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 177.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.52 95.3 1.78 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.214 0.531 . . . . 0.0 111.592 -176.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.1 m -148.24 150.36 33.55 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.123 176.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.44 -164.93 2.14 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 p -57.17 127.55 16.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.142 0.496 . . . . 0.0 110.5 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.483 ' O ' ' HA ' ' A' ' 99' ' ' PRO . . . 106.37 -30.46 9.53 Favored Glycine 0 N--CA 1.445 -0.743 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.177 -178.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.6 p -124.02 -11.17 7.61 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.6 tt -83.06 125.8 40.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.408 0.623 . . . . 0.0 110.751 -177.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.489 ' HB3' ' HB3' ' A' ' 98' ' ' CYS . . . -150.49 178.27 9.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.063 -179.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.42 ' O ' HD23 ' A' ' 81' ' ' LEU . 12.2 m -125.8 137.84 53.8 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.221 173.563 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.475 ' C ' HD22 ' A' ' 81' ' ' LEU . 1.2 m -113.13 156.01 23.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.749 0.309 . . . . 0.0 110.824 -176.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.623 ' HB3' ' HG1' ' A' ' 41' ' ' THR . 16.6 t-20 -141.52 159.39 42.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.959 0.409 . . . . 0.0 111.276 -177.021 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.78 138.52 95.37 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.998 175.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.554 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 11.9 Cg_endo -55.01 -34.61 87.61 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.006 2.471 . . . . 0.0 112.798 -175.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.8 -8.3 42.08 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.048 0.451 . . . . 0.0 111.61 -178.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -108.25 -50.28 3.06 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.623 ' HG1' ' HB3' ' A' ' 36' ' ' ASN . 0.2 OUTLIER -61.57 -35.06 76.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.99 -1.004 . . . . 0.0 111.668 -179.658 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.554 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.7 m-80 -104.11 15.49 28.33 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.644 -172.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -58.91 -28.37 66.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.203 -177.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.921 ' HB3' ' HG ' ' A' ' 47' ' ' LEU . 15.0 t70 -122.52 146.16 47.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.191 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -22.33 62.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.815 -178.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.9 tp -90.38 -27.63 19.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.675 0.274 . . . . 0.0 110.299 178.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.921 ' HG ' ' HB3' ' A' ' 44' ' ' ASP . 19.2 mt -58.77 -40.6 84.4 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.643 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.47 ' HA ' HD22 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -64.87 -24.53 67.56 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.089 -178.056 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.55 -18.03 46.79 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.073 -0.584 . . . . 0.0 111.889 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.93 -18.14 48.13 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.166 0.508 . . . . 0.0 110.024 177.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.527 HD23 HG22 ' A' ' 41' ' ' THR . 0.1 OUTLIER -67.45 -43.19 81.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.696 176.847 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -104.16 86.85 0.53 Allowed Glycine 0 N--CA 1.442 -0.95 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.881 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.4 64.62 5.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.402 0.62 . . . . 0.0 109.559 174.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.36 -121.37 2.97 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 -175.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.525 ' HB3' HG21 ' A' ' 102' ' ' THR . 2.1 mt -111.92 47.59 1.04 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.069 0.462 . . . . 0.0 111.156 178.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.66 143.52 29.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.229 178.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -117.46 -177.56 3.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.711 -176.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -106.35 -142.42 10.84 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.599 -173.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.86 154.28 41.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.887 0.375 . . . . 0.0 111.14 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.0 p -67.93 89.4 0.28 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.905 177.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.87 -45.07 1.47 Allowed Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 116.053 -0.522 . . . . 0.0 112.521 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.48 113.36 12.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.992 0.425 . . . . 0.0 111.064 -177.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.51 114.72 21.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.752 178.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 137.74 -53.08 0.73 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.754 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.53 136.58 44.08 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 176.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.462 ' HB2' ' HG ' ' A' ' 51' ' ' LEU . . . -129.78 167.37 18.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.554 -178.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.441 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -125.43 130.14 51.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.188 178.5 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.827 ' HB2' HD12 ' A' ' 81' ' ' LEU . . . -105.34 136.23 45.27 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.795 0.331 . . . . 0.0 110.117 -178.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.465 ' HE2' ' HG3' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -100.99 155.73 17.81 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.094 -177.825 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.531 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -65.97 -23.61 66.63 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.122 -178.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -27.15 56.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.91 0.862 . . . . 0.0 109.17 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.6 -25.1 21.49 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.303 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.531 HD12 ' HA ' ' A' ' 70' ' ' ALA . 0.8 OUTLIER -63.2 -39.83 86.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.959 179.062 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -78.73 -2.99 42.01 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.17 0.51 . . . . 0.0 110.987 178.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -81.37 -39.16 25.45 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.724 -173.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.2 mp -143.84 14.81 1.73 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.707 -176.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.61 44.18 96.88 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.329 -0.939 . . . . 0.0 111.094 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.455 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 3.8 mp -53.47 126.41 21.36 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.183 -0.508 . . . . 0.0 111.143 -176.187 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.36 -1.8 11.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.772 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.536 ' HB3' HD12 ' A' ' 47' ' ' LEU . . . -79.78 -4.48 52.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.983 -174.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.827 HD12 ' HB2' ' A' ' 68' ' ' ALA . 0.3 OUTLIER -155.05 36.37 0.39 Allowed 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -172.955 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 90' ' ' VAL . 0.0 OUTLIER -140.15 137.96 37.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 120.999 0.428 . . . . 0.0 110.327 175.079 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.941 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 2.3 t0 -109.29 158.5 17.8 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 173.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -124.43 114.96 20.18 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 119.653 -0.819 . . . . 0.0 112.725 -170.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -107.95 -169.95 1.6 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.732 171.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -81.68 -7.62 59.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.72 0.295 . . . . 0.0 111.581 -175.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -104.43 12.95 32.76 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 120.862 0.363 . . . . 0.0 110.782 -178.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 115.42 -166.43 12.22 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.602 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -80.07 136.05 11.41 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 123.369 2.713 . . . . 0.0 111.323 176.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.459 ' O ' HG12 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -140.29 -170.76 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.289 -175.251 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -66.49 132.0 47.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.09 0.472 . . . . 0.0 110.802 -177.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.941 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 6.3 tptp -74.7 -35.29 62.74 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.408 -175.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -155.34 -74.34 0.11 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.603 -175.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.6 mp -98.89 138.11 24.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.39 -172.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 25.7 t -97.28 118.47 43.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.945 178.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -144.03 160.67 40.47 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.745 0.307 . . . . 0.0 110.99 -176.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.13 124.8 50.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.509 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 45.9 t -136.0 117.85 11.89 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.971 -172.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.483 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 89.2 Cg_endo -76.14 138.27 20.18 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 122.863 2.375 . . . . 0.0 112.058 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.465 ' HG3' ' HE2' ' A' ' 69' ' ' LYS . 3.8 tt0 -85.91 139.33 31.33 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.54 176.568 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 128.62 -63.41 0.62 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.976 -0.63 . . . . 0.0 111.55 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.525 HG21 ' HB3' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -167.28 176.18 6.88 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 122.635 0.374 . . . . 0.0 110.196 178.378 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.67 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.7 OUTLIER 73.84 166.11 0.29 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.672 0.749 . . . . 0.0 112.158 177.407 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.67 ' H ' HG22 ' A' ' 103' ' ' THR . 21.5 m-20 -79.01 173.18 12.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.644 -1.162 . . . . 0.0 112.224 -174.129 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.509 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -113.27 142.94 45.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.744 175.381 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -102.91 142.01 17.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.066 0.46 . . . . 0.0 111.215 -175.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -106.86 122.84 47.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.339 177.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.33 17.59 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.931 -177.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -86.42 -42.98 13.17 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.834 -178.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 64.57 25.32 13.17 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.906 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 63.29 172.94 0.16 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.547 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -175.04 -116.44 0.44 Allowed Glycine 0 N--CA 1.443 -0.871 0 N-CA-C 110.794 -0.922 . . . . 0.0 110.794 176.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -160.15 -29.44 0.06 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.867 0.365 . . . . 0.0 111.037 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -86.82 134.78 12.75 Favored Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 178.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.443 ' O ' ' HB3' ' A' ' 116' ' ' LYS . 0.7 OUTLIER -88.7 -43.93 10.95 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.952 0.406 . . . . 0.0 111.123 -176.948 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 115' ' ' THR . 0.0 OUTLIER 171.71 -25.63 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.596 -175.433 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -86.03 78.05 9.51 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.404 0.621 . . . . 0.0 111.089 -177.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 . . . . . 0 C--O 1.245 0.824 0 CA-C-O 118.266 -0.873 . . . . 0.0 108.804 175.674 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 120.564 0.221 . . . . 0.0 110.679 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.01 163.26 58.71 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.353 179.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.31 95.63 0.1 Allowed 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.899 2.4 . . . . 0.0 112.426 176.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -153.69 -119.79 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.881 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -27.98 63.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.15 0.5 . . . . 0.0 110.945 178.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.99 63.66 5.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.468 -178.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -123.41 25.23 8.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.581 176.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.5 mmpt? -117.01 117.19 28.96 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.789 -176.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -113.01 13.96 19.56 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.531 -176.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -97.81 103.82 15.79 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.121 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.2 mmtt -128.61 -179.12 4.88 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.941 0.4 . . . . 0.0 110.548 -177.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.503 ' C ' ' H ' ' A' ' 14' ' ' THR . 3.8 mp -92.51 44.36 1.16 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.39 -179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 69.48 -13.63 0.37 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.716 0.806 . . . . 0.0 111.888 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.503 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -164.26 -55.3 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 177.705 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.446 ' HB2' ' H ' ' A' ' 16' ' ' ALA . 0.3 OUTLIER 56.7 -96.69 0.07 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.991 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.588 ' HB2' ' OE1' ' A' ' 87' ' ' GLU . . . 53.46 -91.97 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.66 0.6 . . . . 0.0 111.507 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.598 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . . . -53.85 -38.78 65.02 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.059 0.457 . . . . 0.0 110.871 174.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.684 ' HA ' ' HD2' ' A' ' 116' ' ' LYS . 65.5 t80 -73.5 -35.18 65.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.539 177.43 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.429 ' O ' ' HG2' ' A' ' 23' ' ' GLU . . . -65.16 -21.06 66.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.577 -174.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.598 ' HE3' ' HA ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -52.4 -24.43 7.73 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.943 0.401 . . . . 0.0 111.115 177.033 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.499 ' HG3' ' HE3' ' A' ' 116' ' ' LYS . 1.0 OUTLIER -64.93 -31.49 72.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.918 179.088 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.46 -17.25 27.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.21 -176.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.474 ' HG3' ' HA ' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -97.26 -45.31 6.55 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.871 -179.26 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.57 -37.07 21.42 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.377 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.94 153.43 28.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.871 0.367 . . . . 0.0 111.025 -177.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.66 98.35 11.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.999 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.2 m -135.5 170.8 15.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.746 176.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -111.16 164.83 12.45 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.053 -173.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.628 HG13 ' N ' ' A' ' 30' ' ' GLY . 0.3 OUTLIER -61.06 -35.52 65.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.243 -178.882 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.628 ' N ' HG13 ' A' ' 29' ' ' VAL . . . -107.14 35.97 4.69 Favored Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 176.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.742 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 15.6 m -145.84 -9.29 0.54 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.409 -0.395 . . . . 0.0 111.263 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.507 ' O ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -81.18 126.11 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.034 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.12 -179.33 6.95 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.336 0.589 . . . . 0.0 112.061 -169.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 7.8 t -136.86 141.07 42.78 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.124 172.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -122.61 151.66 41.23 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.082 -178.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -135.71 157.05 47.81 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.66 135.54 7.8 Favored Pre-proline 0 C--N 1.33 -0.252 0 O-C-N 124.05 0.843 . . . . 0.0 110.922 177.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -49.91 -38.68 48.78 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.589 2.859 . . . . 0.0 113.609 -174.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.45 -8.86 54.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.973 0.416 . . . . 0.0 111.663 -177.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -109.13 -35.37 6.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.143 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -42.22 81.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.611 0.72 . . . . 0.0 110.259 175.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -95.27 15.46 19.22 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.531 -178.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -58.72 -32.3 69.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.886 178.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.999 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 24.7 t70 -108.4 136.1 48.6 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.672 174.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -25.28 65.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.733 0.301 . . . . 0.0 111.573 -176.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.3 tp -91.78 -22.85 19.94 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.956 178.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.999 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.1 OUTLIER -55.92 -46.45 78.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.273 -178.362 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.8 -24.2 66.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.039 0.447 . . . . 0.0 111.358 -179.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -96.03 -5.89 59.37 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.579 -0.819 . . . . 0.0 111.74 177.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.78 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 1.3 tp -83.96 -33.52 24.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.826 0.346 . . . . 0.0 110.194 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.86 -32.54 63.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.362 178.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.644 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -84.9 69.04 3.39 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.551 -0.833 . . . . 0.0 111.996 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.27 55.46 2.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.419 0.628 . . . . 0.0 109.812 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 141.27 -112.42 0.77 Allowed Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.611 -0.996 . . . . 0.0 110.611 -175.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.72 60.29 1.03 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.159 0.504 . . . . 0.0 110.215 175.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.644 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 0.2 OUTLIER -87.08 142.13 28.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.165 178.768 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.544 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 1.0 OUTLIER -111.59 -178.0 3.33 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.382 -176.742 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -109.84 -155.12 15.34 Favored Glycine 0 C--O 1.227 -0.305 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.148 -175.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.447 ' HA ' HD23 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -65.7 146.45 54.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.794 0.33 . . . . 0.0 110.64 176.838 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.9 m -66.09 93.15 0.19 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.778 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 109.83 -58.87 0.37 Allowed Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.868 -178.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -71.71 99.43 2.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.034 0.445 . . . . 0.0 110.615 -179.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.73 70.27 8.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.394 0.616 . . . . 0.0 110.586 179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -166.72 -54.47 0.03 OUTLIER Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.536 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.69 120.28 14.43 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 175.222 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -115.74 142.16 47.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.559 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -110.98 128.95 56.01 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.593 -178.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.51 ' CB ' HD11 ' A' ' 81' ' ' LEU . . . -111.63 140.5 46.2 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.013 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.701 ' HD2' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -94.69 174.65 7.0 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.32 -174.733 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.26 -31.36 71.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.104 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.467 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.9 OUTLIER -67.13 -36.31 81.62 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.702 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.24 -36.16 61.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.494 178.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.8 mt -61.51 -41.73 91.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.295 0.569 . . . . 0.0 109.641 175.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -77.22 -7.36 55.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.001 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.467 ' HB2' ' O ' ' A' ' 71' ' ' SER . 2.0 tp-100 -95.03 -54.35 3.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.873 -177.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.78 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -122.87 -6.4 8.49 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -173.148 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 65.79 49.74 57.46 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.546 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.532 HD13 ' HB2' ' A' ' 76' ' ' LEU . 4.4 mp -70.95 97.5 1.44 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.735 0.302 . . . . 0.0 111.516 -176.75 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.78 ' HA ' HG11 ' A' ' 82' ' ' VAL . 0.0 OUTLIER -86.86 18.51 3.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.932 0.396 . . . . 0.0 111.323 179.743 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.4 -26.36 35.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.895 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.51 HD11 ' CB ' ' A' ' 68' ' ' ALA . 0.1 OUTLIER -126.03 -4.34 6.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.647 -178.309 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.78 HG11 ' HA ' ' A' ' 79' ' ' LEU . 1.9 p -104.68 141.33 20.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.21 0.529 . . . . 0.0 110.704 -177.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -129.37 174.92 9.18 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.465 177.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -133.67 107.76 8.14 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.951 0.405 . . . . 0.0 111.049 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.536 ' C ' ' H ' ' A' ' 87' ' ' GLU . 17.5 p -79.97 -168.82 1.76 Allowed 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 173.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -75.9 28.02 0.11 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.165 0.507 . . . . 0.0 110.403 173.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.588 ' OE1' ' HB2' ' A' ' 16' ' ' ALA . 1.4 mm-40 -126.39 -101.32 0.37 Allowed 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.501 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -135.58 -158.83 8.36 Favored Glycine 0 N--CA 1.445 -0.71 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 178.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -69.01 117.84 5.29 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.552 2.168 . . . . 0.0 111.12 176.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.495 HG22 HG22 ' A' ' 85' ' ' THR . 2.5 m -129.14 170.89 17.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.174 0.511 . . . . 0.0 111.74 -173.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.488 ' HB2' ' HE2' ' A' ' 116' ' ' LYS . 2.4 t -67.82 118.86 11.62 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.167 177.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 35.7 tttp -69.27 -30.15 68.2 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.114 -178.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.473 ' HB3' ' H ' ' A' ' 94' ' ' ILE . 0.6 OUTLIER -152.29 -105.84 0.05 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.142 0.496 . . . . 0.0 111.989 -173.407 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.473 ' H ' ' HB3' ' A' ' 93' ' ' ASN . 3.7 mt -76.61 126.6 37.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.781 -168.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -91.7 132.22 36.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 175.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -152.87 158.91 42.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.969 -176.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -105.85 116.71 32.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.966 0.412 . . . . 0.0 110.01 179.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.742 ' O ' ' HA ' ' A' ' 31' ' ' SER . 5.6 t -129.5 117.31 18.64 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.083 -173.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -73.71 146.1 37.9 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 122.648 2.232 . . . . 0.0 112.748 -178.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.4 ' CD ' ' HZ3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -89.3 129.11 35.9 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 173.272 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 130.09 -60.89 0.67 Allowed Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.792 -0.718 . . . . 0.0 111.91 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -169.36 174.79 5.85 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 122.917 0.487 . . . . 0.0 109.949 176.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 17.2 m 79.42 144.86 0.08 Allowed 'General case' 0 N--CA 1.462 0.159 0 O-C-N 124.043 0.84 . . . . 0.0 111.942 176.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.544 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -70.67 176.02 4.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.491 -1.231 . . . . 0.0 111.185 -178.049 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.477 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -110.96 141.96 43.7 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.898 -176.151 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.416 ' O ' HG23 ' A' ' 106' ' ' VAL . 3.3 m -88.07 145.75 7.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.289 177.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.92 121.45 45.27 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.891 0.377 . . . . 0.0 111.084 -177.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.28 30.52 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.564 177.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 34.3 p-10 -76.04 -11.48 59.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.409 -175.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.54 -53.34 53.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.174 0.512 . . . . 0.0 111.314 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -97.94 47.12 1.01 Allowed 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.799 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -148.38 64.29 0.41 Allowed Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.769 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -78.9 65.76 4.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.049 0.452 . . . . 0.0 111.036 -176.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 147.4 85.84 0.06 OUTLIER Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.982 -0.628 . . . . 0.0 111.684 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.52 HG22 ' O ' ' A' ' 115' ' ' THR . 12.2 t -75.75 118.31 18.43 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.261 0.553 . . . . 0.0 111.16 -176.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.684 ' HD2' ' HA ' ' A' ' 18' ' ' PHE . 0.8 OUTLIER 58.55 42.36 20.94 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.034 176.353 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -118.76 144.68 46.12 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.394 -176.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 . . . . . 0 C--O 1.247 0.942 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 176.416 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 11.2 m . . . . . 0 N--CA 1.476 0.874 0 CA-C-O 120.692 0.282 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.46 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.1 OUTLIER -73.44 140.31 79.02 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.676 178.884 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 2' ' ' LEU . 8.3 Cg_exo -75.04 -179.37 4.93 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 123.137 2.558 . . . . 0.0 112.297 178.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 66.67 -70.17 0.11 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.529 0.732 . . . . 0.0 112.019 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.37 144.39 46.47 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.458 -179.012 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.2 65.68 3.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.357 0.599 . . . . 0.0 110.607 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.1 -0.57 22.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.872 -176.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.9 mmtt -84.77 -1.17 55.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.239 0.543 . . . . 0.0 110.383 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -91.86 -22.07 20.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.324 178.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.812 ' HB1' ' HB2' ' A' ' 74' ' ' ASP . . . -70.2 95.38 0.99 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.172 -177.248 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.456 ' HD2' ' HG2' ' A' ' 89' ' ' PRO . 0.5 OUTLIER -112.78 -93.36 0.47 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.065 179.119 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 65.0 6.87 3.66 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.696 0.622 . . . . 0.0 110.834 -176.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.14 -32.88 5.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.31 0.576 . . . . 0.0 110.221 178.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.29 -22.02 45.21 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.895 178.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.11 76.23 6.86 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.599 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.8 -28.36 65.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.315 0.579 . . . . 0.0 110.076 175.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.707 ' HB1' ' HB2' ' A' ' 116' ' ' LYS . . . -64.64 -33.44 75.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.397 177.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -72.67 -30.88 64.64 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.406 ' O ' ' HB3' ' A' ' 22' ' ' ALA . . . -66.51 -38.28 86.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.939 174.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -69.97 -36.88 75.55 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.688 0.756 . . . . 0.0 109.072 175.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.91 -25.24 68.06 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.787 176.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 19' ' ' ALA . . . -68.61 -14.96 63.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.45 . . . . 0.0 112.019 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -110.6 9.4 23.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.096 0.474 . . . . 0.0 110.383 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.28 -12.5 73.15 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 175.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.3 m -151.83 139.97 20.24 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 176.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.73 97.29 1.06 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.639 0.257 . . . . 0.0 110.97 -179.109 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.8 m -149.21 165.59 31.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.123 -177.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.52 ' O ' ' HB ' ' A' ' 32' ' ' ILE . 21.2 m120 -115.83 174.7 5.89 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 t -55.6 -42.99 71.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -178.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.24 9.43 72.22 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.423 -0.894 . . . . 0.0 113.131 -176.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.489 ' OG ' ' HB2' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -131.57 2.71 4.15 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.139 0.495 . . . . 0.0 110.958 -179.82 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.607 ' O ' HG22 ' A' ' 32' ' ' ILE . 0.9 OUTLIER -89.8 132.7 33.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.577 -179.484 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.652 ' HB3' ' HD2' ' A' ' 69' ' ' LYS . . . -145.07 156.16 43.75 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.485 0.659 . . . . 0.0 111.791 -175.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.794 ' HB3' HD22 ' A' ' 81' ' ' LEU . 44.3 t -108.64 130.85 55.32 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 115.107 -0.951 . . . . 0.0 108.514 172.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.629 ' SG ' ' HB2' ' A' ' 96' ' ' ALA . 60.1 m -116.68 154.43 30.6 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -178.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.618 ' OD1' ' HB ' ' A' ' 41' ' ' THR . 12.7 p30 -152.3 159.19 43.53 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.519 177.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.88 133.42 66.7 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.733 176.633 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.7 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 54.8 Cg_exo -49.86 -31.42 26.53 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.557 2.838 . . . . 0.0 113.607 -172.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.25 -19.93 49.92 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -177.012 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.96 -53.18 3.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.772 -177.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.618 ' HB ' ' OD1' ' A' ' 36' ' ' ASN . 0.4 OUTLIER -69.4 -25.07 63.96 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.541 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.7 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.4 m-80 -91.98 15.78 12.5 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.041 -177.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -49.4 -33.73 14.56 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.894 -179.175 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.781 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 6.2 t70 -119.3 152.35 36.87 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.678 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.0 -24.32 40.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.396 -175.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 tp -85.36 -36.28 20.85 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 175.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.781 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -52.3 -39.88 61.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.542 175.983 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.06 -18.25 65.14 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.145 -177.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -97.32 -25.88 10.63 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.065 -0.588 . . . . 0.0 111.837 176.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 94.2 mt -75.68 -9.04 58.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.771 0.319 . . . . 0.0 110.778 179.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.611 ' HG ' ' HB3' ' A' ' 66' ' ' ALA . 0.1 OUTLIER -65.81 -13.53 59.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.007 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.41 ' HA3' ' HB2' ' A' ' 56' ' ' LEU . . . -148.91 94.05 0.15 Allowed Glycine 0 N--CA 1.444 -0.815 0 N-CA-C 111.228 -0.749 . . . . 0.0 111.228 176.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.42 63.46 5.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.02 0.438 . . . . 0.0 111.459 -171.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 154.49 52.94 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.546 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 60.75 43.69 11.95 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.919 0.39 . . . . 0.0 111.619 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.708 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 0.1 OUTLIER -85.95 -174.36 5.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.935 0.398 . . . . 0.0 111.084 179.712 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.494 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 10.5 t-20 -132.88 -178.28 4.88 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.201 -178.478 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.524 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -107.42 -146.3 12.73 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.717 -0.674 . . . . 0.0 112.156 -177.282 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 12.9 tp -65.69 145.96 55.38 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.0 t -53.93 109.77 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.842 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.29 -51.08 4.44 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.81 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 24.6 t30 -81.32 94.35 6.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.307 0.575 . . . . 0.0 111.172 -176.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.73 129.08 38.68 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.324 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 131.95 -51.17 0.86 Allowed Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.793 178.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.89 68.82 7.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.878 0.371 . . . . 0.0 110.95 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.611 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . . . -79.95 137.77 36.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.745 176.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.3 m -110.83 141.51 44.09 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.109 0.48 . . . . 0.0 111.774 -174.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.593 ' H ' HD11 ' A' ' 81' ' ' LEU . . . -104.76 156.16 18.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.905 178.165 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.684 ' HE2' ' HG2' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -111.7 -178.42 3.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.201 -172.939 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.61 -37.96 83.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.695 0.283 . . . . 0.0 111.342 -177.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -41.39 94.9 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.473 0.654 . . . . 0.0 110.103 177.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.529 ' HA ' ' NE2' ' A' ' 75' ' ' GLN . 1.1 mp -72.57 -17.08 61.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.162 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -66.03 -34.09 67.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 173.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.812 ' HB2' ' HB1' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -101.01 -39.33 7.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.55 -174.702 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.529 ' NE2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -51.8 -29.68 20.08 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -174.8 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.14 -17.82 0.4 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 111.871 0.322 . . . . 0.0 111.871 -178.479 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.41 51.96 5.01 Favored Glycine 0 CA--C 1.519 0.304 0 C-N-CA 119.935 -1.126 . . . . 0.0 112.406 178.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.02 84.62 0.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.107 0.479 . . . . 0.0 111.018 -178.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.463 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -69.55 -6.24 29.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.565 -174.693 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -77.72 -16.49 58.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.825 0.345 . . . . 0.0 110.735 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.794 HD22 ' HB3' ' A' ' 34' ' ' CYS . 0.4 OUTLIER -105.54 -25.09 12.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.517 -175.907 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.44 138.85 24.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.0 0.428 . . . . 0.0 111.007 -177.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.467 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 5.8 t70 -117.85 159.26 23.37 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 174.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.506 ' CE1' ' HA2' ' A' ' 88' ' ' GLY . 23.8 t-80 -111.58 110.91 21.56 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.204 0.526 . . . . 0.0 110.858 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.821 ' HG1' HG23 ' A' ' 90' ' ' VAL . 19.3 p -97.07 -167.81 1.6 Allowed 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.093 177.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.464 ' H ' ' HG3' ' A' ' 86' ' ' GLU . 16.6 mt-10 -51.12 -44.06 61.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.531 177.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.472 ' CD ' ' HZ1' ' A' ' 116' ' ' LYS . 48.9 mp0 -72.83 -75.42 0.14 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.842 0.353 . . . . 0.0 111.148 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.506 ' HA2' ' CE1' ' A' ' 84' ' ' HIS . . . -168.65 -151.48 7.18 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.617 -176.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.456 ' HG2' ' HD2' ' A' ' 11' ' ' LYS . 13.4 Cg_exo -69.82 107.9 1.97 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 123.128 2.552 . . . . 0.0 111.703 178.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.821 HG23 ' HG1' ' A' ' 85' ' ' THR . 1.0 OUTLIER -125.61 -173.3 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.014 -176.726 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 50.1 t -67.72 134.13 50.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.41 177.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.467 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttt -73.65 -36.04 65.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.792 -178.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.514 ' HB3' HG13 ' A' ' 94' ' ' ILE . 4.8 m-80 -146.66 -95.22 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -171.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.514 HG13 ' HB3' ' A' ' 93' ' ' ASN . 3.5 mt -93.57 132.86 36.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.888 -168.701 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.49 130.82 36.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.501 177.03 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.629 ' HB2' ' SG ' ' A' ' 35' ' ' CYS . . . -154.52 175.8 13.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.051 0.453 . . . . 0.0 111.476 -178.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.97 125.69 54.68 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.555 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.62 ' HB3' ' HD2' ' A' ' 69' ' ' LYS . 15.3 t -144.22 129.01 9.38 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.18 -176.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.411 ' O ' HD23 ' A' ' 56' ' ' LEU . 67.5 Cg_endo -87.86 129.83 2.56 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 122.95 2.433 . . . . 0.0 112.818 -176.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.684 ' HG2' ' HE2' ' A' ' 69' ' ' LYS . 4.7 mm-40 -77.31 97.28 4.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.109 0.48 . . . . 0.0 110.691 176.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.447 ' O ' ' HB ' ' A' ' 102' ' ' THR . . . 169.67 -53.01 0.2 Allowed Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 177.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.708 ' HA ' ' HA ' ' A' ' 56' ' ' LEU . 5.8 t 177.07 -176.33 0.14 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 71.95 158.96 0.2 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.343 0.592 . . . . 0.0 111.099 -176.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.494 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 1.0 OUTLIER -76.17 173.88 10.79 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.498 -175.755 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.515 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -111.25 150.65 29.3 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.931 -179.467 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 6.0 m -106.6 133.48 51.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.891 0.377 . . . . 0.0 110.64 -177.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.98 119.55 39.67 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.316 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -114.28 13.44 8.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.062 0.458 . . . . 0.0 110.765 -178.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.17 122.3 19.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.312 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -130.68 81.43 2.0 Allowed 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.228 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 66.3 40.16 3.83 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.338 -177.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -116.31 -28.41 2.6 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.933 176.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 93' ' ' ASN . . . -68.17 151.35 47.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.052 0.453 . . . . 0.0 111.363 178.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 119.54 -14.2 10.8 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.315 -179.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.4 t -137.82 170.06 16.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.904 0.383 . . . . 0.0 110.572 178.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.707 ' HB2' ' HB1' ' A' ' 17' ' ' ALA . 0.0 OUTLIER -128.79 -32.73 2.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.289 0.566 . . . . 0.0 110.182 179.817 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -120.69 139.85 52.46 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.751 -0.658 . . . . 0.0 109.894 177.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.443 -0.789 . . . . 0.0 109.977 178.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 CA-C-O 120.416 0.15 . . . . 0.0 110.857 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.406 ' HA ' HD13 ' A' ' 2' ' ' LEU . 1.3 mm? 53.31 74.13 0.82 Allowed Pre-proline 0 CA--C 1.531 0.248 0 O-C-N 123.906 0.754 . . . . 0.0 112.381 176.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -82.79 24.45 0.74 Allowed 'Trans proline' 0 CA--C 1.528 0.217 0 C-N-CA 122.967 2.445 . . . . 0.0 112.546 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.72 -33.0 74.86 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.329 -175.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.91 -7.6 59.53 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.313 179.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.51 3.08 45.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.041 0.448 . . . . 0.0 110.801 -179.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.59 143.8 54.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.903 179.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -149.6 127.08 11.54 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.293 0.568 . . . . 0.0 110.49 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -113.72 -151.01 0.47 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.104 -178.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -86.54 68.79 10.28 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.038 -178.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.09 150.86 27.96 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.186 176.147 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.491 HD11 ' O ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER -78.75 -27.78 44.79 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.314 174.312 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.68 -28.72 69.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.629 -179.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.06 -27.06 61.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.184 0.516 . . . . 0.0 111.074 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -88.22 68.17 8.94 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.448 -176.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.51 -31.47 69.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.65 ' HB2' ' HB2' ' A' ' 117' ' ' ALA . . . -63.6 -29.45 70.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.934 174.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -84.47 -29.62 25.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.974 0.416 . . . . 0.0 110.466 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.43 -4.46 22.65 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.975 -178.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.47 -24.78 31.64 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 176.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.428 ' OE1' ' HA ' ' A' ' 116' ' ' LYS . 0.0 OUTLIER -73.32 -27.34 61.47 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.858 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.12 -11.27 60.77 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.846 178.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -101.8 -47.54 4.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.103 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -72.08 -44.87 43.66 Favored Glycine 0 C--N 1.33 0.199 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.8 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.506 HG23 HG22 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -87.36 136.4 32.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.742 0.306 . . . . 0.0 110.918 -178.948 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.74 96.0 7.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.882 0.372 . . . . 0.0 111.618 -177.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 98.9 m -144.47 -178.85 6.19 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 176.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 31.8 t30 -102.66 134.78 45.46 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.4 p -62.57 -29.27 46.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 O-C-N 123.214 0.321 . . . . 0.0 111.334 -177.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -88.84 8.35 79.77 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.734 -0.746 . . . . 0.0 111.754 177.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.3 m -149.63 42.94 0.91 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.084 0.468 . . . . 0.0 110.408 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.499 ' O ' HG23 ' A' ' 32' ' ' ILE . 0.8 OUTLIER -97.65 140.14 18.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 176.397 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.518 ' HB1' ' HB3' ' A' ' 98' ' ' CYS . . . -148.67 160.88 42.73 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 121.194 0.521 . . . . 0.0 111.717 -173.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 21.5 m -114.6 131.98 56.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.158 173.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.404 ' HB2' ' HB ' ' A' ' 94' ' ' ILE . 2.8 m -122.23 164.94 16.98 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.297 -178.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.475 ' OD1' ' HB3' ' A' ' 92' ' ' LYS . 1.1 t30 -147.42 159.91 43.17 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.258 -179.571 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.05 142.1 37.1 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.786 175.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.5 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 83.9 Cg_exo -47.6 -44.84 24.99 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.858 3.038 . . . . 0.0 114.73 -173.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.47 -15.32 62.53 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -173.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.445 ' CD ' ' HZ3' ' A' ' 92' ' ' LYS . 4.7 mt-10 -98.59 -48.52 4.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.539 0.685 . . . . 0.0 109.631 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.626 HG23 HD23 ' A' ' 51' ' ' LEU . 3.6 m -61.13 -34.6 75.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.11 177.238 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.5 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.1 m-80 -104.93 15.2 28.17 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.779 -177.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -53.83 -40.16 66.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.481 -177.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 1.124 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.1 t70 -102.66 146.93 27.46 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.74 -179.343 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -34.19 77.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.86 -177.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.447 ' HA ' HD13 ' A' ' 46' ' ' LEU . 6.3 tp -92.28 -24.29 19.02 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.089 0.471 . . . . 0.0 110.736 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 1.124 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -58.85 -31.76 68.82 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.515 -177.613 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.678 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -63.01 -11.76 21.28 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -176.537 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -117.42 -21.49 4.37 Favored Glycine 0 C--N 1.331 0.301 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 172.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.2 mp -84.3 -7.21 59.4 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.702 ' HA ' ' HG ' ' A' ' 78' ' ' LEU . 0.3 OUTLIER -70.55 -9.0 55.7 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.301 0.572 . . . . 0.0 109.975 179.08 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.753 ' HA2' HD21 ' A' ' 72' ' ' LEU . . . -128.44 -125.99 2.82 Favored Glycine 0 N--CA 1.438 -1.224 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 176.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -168.76 -24.6 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.358 0.599 . . . . 0.0 109.669 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -126.1 -157.98 9.76 Favored Glycine 0 N--CA 1.443 -0.878 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 172.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.484 HD23 ' HA ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -75.53 64.79 1.67 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.182 0.515 . . . . 0.0 110.927 179.761 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.745 HD13 ' H ' ' A' ' 56' ' ' LEU . 0.0 OUTLIER -65.55 150.62 48.1 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.778 178.294 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -109.22 177.89 4.62 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 171.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -110.18 -154.18 14.38 Favored Glycine 0 CA--C 1.504 -0.603 0 C-N-CA 120.361 -0.923 . . . . 0.0 111.993 -173.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.651 ' HB3' ' HB2' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -65.46 139.54 58.52 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 178.37 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.2 m -56.77 96.48 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.5 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.11 19.12 56.46 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.883 178.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.651 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 1.1 t-20 -127.92 95.03 4.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.182 0.515 . . . . 0.0 109.92 178.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.33 88.4 3.14 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.612 -176.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 153.96 -43.74 0.6 Allowed Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.968 -0.634 . . . . 0.0 111.798 176.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.6 98.94 7.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.947 0.404 . . . . 0.0 110.675 179.007 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.51 171.58 9.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.982 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 79.4 m -134.68 140.08 45.73 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.273 -175.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.425 ' HB3' HD21 ' A' ' 81' ' ' LEU . . . -104.81 124.73 49.94 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.407 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.511 ' H ' ' HG2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -85.19 157.17 20.71 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.259 -175.465 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.84 -36.31 72.11 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 m -63.55 -31.91 73.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.191 0.52 . . . . 0.0 110.44 176.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.753 HD21 ' HA2' ' A' ' 52' ' ' GLY . 0.3 OUTLIER -85.88 -18.82 31.72 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.897 -177.57 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.77 -37.98 81.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 172.115 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -79.8 -6.84 58.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.667 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.803 ' HB3' HD13 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -95.1 -42.3 8.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.245 -178.137 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.803 HD13 ' HB3' ' A' ' 75' ' ' GLN . 4.2 mp -134.79 -65.52 0.63 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.767 -177.437 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.58 50.27 1.86 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.35 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.702 ' HG ' ' HA ' ' A' ' 51' ' ' LEU . 1.8 mm? -59.66 107.03 0.54 Allowed 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 122.613 0.365 . . . . 0.0 110.797 -178.571 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.451 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.58 17.1 0.16 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.428 -171.941 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -93.13 -29.23 15.87 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.225 0.536 . . . . 0.0 109.659 173.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.425 HD21 ' HB3' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -105.11 -1.7 25.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.664 -173.016 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.483 ' C ' ' HG2' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -123.6 137.61 56.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.292 0.568 . . . . 0.0 111.295 -178.955 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -90.19 174.06 7.82 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 173.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.7 72.28 1.4 Allowed 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 122.039 0.923 . . . . 0.0 110.508 -176.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.565 HG22 ' HE3' ' A' ' 116' ' ' LYS . 98.0 m -72.76 158.57 35.32 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 114.099 -1.409 . . . . 0.0 109.665 175.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -53.43 -35.59 60.62 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -177.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.03 -63.82 1.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.468 0.652 . . . . 0.0 110.327 177.379 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -173.37 -174.56 40.49 Favored Glycine 0 N--CA 1.44 -1.072 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -69.96 132.34 22.81 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.032 1.821 . . . . 0.0 110.846 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 82' ' ' VAL . 0.0 OUTLIER -133.57 -178.53 2.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.934 -169.411 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.43 133.7 50.04 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.256 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.483 ' HG2' ' C ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -71.67 -46.84 57.66 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 -177.074 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -150.68 -70.54 0.18 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.837 -171.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.404 ' HB ' ' HB2' ' A' ' 35' ' ' CYS . 15.7 mt -98.88 120.91 48.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.183 -174.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.6 p -93.51 129.96 43.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.455 ' HB2' ' O ' ' A' ' 106' ' ' VAL . . . -148.81 169.72 19.84 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.398 0.618 . . . . 0.0 111.561 -174.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.16 115.97 31.17 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.217 175.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.518 ' HB3' ' HB1' ' A' ' 33' ' ' ALA . 38.9 t -136.38 126.3 16.08 Favored Pre-proline 0 C--N 1.319 -0.723 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.87 -173.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -67.21 134.38 33.61 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.721 2.281 . . . . 0.0 111.462 178.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.433 ' HA ' ' HG3' ' A' ' 69' ' ' LYS . 1.3 tt0 -67.03 118.23 10.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.106 0.479 . . . . 0.0 109.894 176.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.689 ' O ' ' HA ' ' A' ' 56' ' ' LEU . . . 113.9 -115.93 3.73 Favored Glycine 0 N--CA 1.437 -1.296 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -176.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 66.8 p -98.83 -174.84 2.89 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 123.659 0.27 . . . . 0.0 110.802 -173.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.1 m 74.07 151.67 0.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.686 0.755 . . . . 0.0 112.058 177.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -76.34 159.77 30.22 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.027 -175.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.504 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.4 141.41 46.17 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.893 -179.75 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.567 HG21 ' O ' ' A' ' 106' ' ' VAL . 1.7 m -99.37 135.2 35.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.164 0.507 . . . . 0.0 111.185 -178.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.504 ' HB3' HD22 ' A' ' 59' ' ' LEU . . . -100.52 112.01 24.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.537 176.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.506 HG22 HG23 ' A' ' 25' ' ' THR . 1.8 m -94.45 21.71 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -170.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -118.9 133.85 55.56 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.34 0.59 . . . . 0.0 111.108 177.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -151.7 25.6 0.66 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.888 -1.051 . . . . 0.0 108.582 173.034 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -133.45 -36.27 0.98 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.611 -175.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 77.53 80.0 0.69 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.778 -0.725 . . . . 0.0 111.866 -177.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -86.79 -43.53 12.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.151 0.501 . . . . 0.0 111.673 -177.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -164.8 -171.22 30.78 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.691 -178.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -107.43 -60.0 1.75 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.975 0.417 . . . . 0.0 111.123 -178.163 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.565 ' HE3' HG22 ' A' ' 85' ' ' THR . 0.0 OUTLIER -154.72 -79.35 0.09 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 175.474 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . 0.65 ' HB2' ' HB2' ' A' ' 17' ' ' ALA . . . -95.2 77.9 3.48 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 171.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 . . . . . 0 C--O 1.256 1.435 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.668 -173.247 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.492 ' C ' ' H ' ' A' ' 14' ' ' THR . 7.8 mp . . . . . 0 C--O 1.234 0.283 0 CA-C-O 120.193 0.044 . . . . 0.0 110.905 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 68.96 -33.4 0.24 Allowed 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.362 0.665 . . . . 0.0 111.536 -177.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.492 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -153.62 -51.36 0.1 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.066 178.146 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.417 ' HG ' ' N ' ' A' ' 12' ' ' LEU . 26.4 m 66.73 -78.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.813 -177.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 52.23 -87.71 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.636 0.585 . . . . 0.0 110.964 -177.121 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.01 84.62 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.63 174.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -69.18 -25.75 64.5 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.044 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.59 -40.28 66.69 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.942 175.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.83 -35.72 80.84 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 174.127 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.47 -46.9 88.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.211 174.365 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.83 -18.28 64.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.739 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.08 -33.92 13.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.87 178.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.66 -24.4 58.5 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.3 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.71 133.47 52.75 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.801 0.334 . . . . 0.0 110.345 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.33 96.55 4.64 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.104 0.478 . . . . 0.0 111.383 -178.061 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.4 m -142.04 -177.78 5.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.057 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -117.2 157.34 26.17 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.288 -179.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.419 HG22 ' H ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -68.36 -48.54 72.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -173.555 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.37 9.37 61.58 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.812 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 m -139.57 31.4 2.08 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.164 0.507 . . . . 0.0 110.034 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -90.54 127.93 42.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.383 -179.489 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.88 169.11 21.27 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.085 0.469 . . . . 0.0 111.474 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.432 ' O ' HD22 ' A' ' 81' ' ' LEU . 8.8 t -125.72 140.12 52.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.194 172.434 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.605 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 0.3 OUTLIER -121.91 138.99 54.19 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.639 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.492 HD22 ' HB2' ' A' ' 40' ' ' GLU . 10.1 t30 -116.16 160.18 20.73 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.77 -179.406 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.91 126.92 3.22 Favored Pre-proline 0 C--O 1.237 0.443 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.111 172.552 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.46 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 7.9 Cg_endo -49.69 -38.74 46.74 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.909 3.072 . . . . 0.0 114.198 -171.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.74 -23.96 66.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.758 0.313 . . . . 0.0 111.666 -175.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.492 ' HB2' HD22 ' A' ' 36' ' ' ASN . 51.2 mm-40 -96.49 -41.76 8.42 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 0.0 110.27 -178.369 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.451 ' HA ' ' HB1' ' A' ' 80' ' ' ALA . 2.0 m -62.44 -33.65 75.24 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.447 0.641 . . . . 0.0 110.468 175.53 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.6 OUTLIER -104.13 16.01 27.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.5 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -52.97 -48.58 67.31 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.212 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 1.001 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 7.4 t70 -94.53 136.12 35.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.885 175.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -27.44 67.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.103 0.478 . . . . 0.0 110.493 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.01 -26.4 29.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.251 178.052 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 1.001 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -60.13 -37.06 78.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.331 178.39 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.32 -34.07 70.19 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.09 179.043 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -94.11 -12.91 55.83 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.104 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -77.01 -33.98 57.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.022 0.439 . . . . 0.0 110.664 -178.217 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.453 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.6 OUTLIER -73.43 -30.22 63.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.151 0.5 . . . . 0.0 110.748 179.162 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.664 ' HA2' ' HG ' ' A' ' 56' ' ' LEU . . . -91.31 60.44 2.97 Favored Glycine 0 N--CA 1.443 -0.898 0 C-N-CA 121.058 -0.592 . . . . 0.0 112.429 -177.389 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.81 -24.86 67.92 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.91 0.386 . . . . 0.0 111.034 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -118.12 22.71 9.59 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.542 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.592 ' O ' HG23 ' A' ' 102' ' ' THR . 21.4 tp 66.27 44.18 2.57 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.162 0.506 . . . . 0.0 110.624 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.664 ' HG ' ' HA2' ' A' ' 52' ' ' GLY . 0.2 OUTLIER -86.07 178.28 7.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.091 -177.648 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -120.06 -176.08 3.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.744 -175.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -100.92 -154.36 26.81 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.295 -174.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.573 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 8.2 tp -66.68 140.38 57.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.831 0.316 . . . . 0.0 110.537 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.65 97.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.723 -178.21 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 103.16 -10.36 54.88 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.875 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.573 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 2.6 t-20 -129.27 93.55 3.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.187 0.518 . . . . 0.0 110.85 -178.402 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 28.6 m -75.1 93.77 2.81 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.712 176.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 173.4 -58.01 0.14 Allowed Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 178.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.44 84.01 5.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.979 0.418 . . . . 0.0 110.208 177.094 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.63 155.89 29.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.054 177.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.7 m -122.33 131.53 53.95 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.891 0.377 . . . . 0.0 111.422 -177.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.711 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -105.13 134.57 48.01 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.879 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.828 ' HD2' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -89.2 167.19 13.29 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.703 -174.066 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.483 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -58.98 -32.87 70.05 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.413 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -37.85 71.2 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.413 0.625 . . . . 0.0 109.519 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.421 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -65.8 -31.93 73.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.046 175.719 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.483 HD12 ' HA ' ' A' ' 70' ' ' ALA . 3.9 mt -65.37 -35.67 75.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.318 177.528 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -84.08 -6.49 59.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.064 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -94.78 -43.86 8.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.292 0.568 . . . . 0.0 109.9 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.2 mp -132.43 -53.87 0.96 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.562 -176.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.18 51.17 2.28 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.034 -179.029 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.524 ' H ' HD22 ' A' ' 78' ' ' LEU . 1.9 mm? -54.04 100.45 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 122.683 0.393 . . . . 0.0 111.432 -177.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.488 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -76.17 1.72 15.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.55 -176.426 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.451 ' HB1' ' HA ' ' A' ' 41' ' ' THR . . . -72.28 -33.64 67.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.917 0.389 . . . . 0.0 110.946 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.711 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.8 OUTLIER -119.61 4.53 11.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.916 0.389 . . . . 0.0 111.431 -176.837 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.601 HG23 HD12 ' A' ' 81' ' ' LEU . 97.0 t -109.0 138.8 34.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.887 178.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.896 ' HB2' ' HD3' ' A' ' 92' ' ' LYS . 29.2 t70 -123.43 153.19 40.77 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.064 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -118.14 132.35 56.35 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.4 0.619 . . . . 0.0 111.586 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.476 HG23 ' H ' ' A' ' 87' ' ' GLU . 11.7 t -138.66 174.76 10.19 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.812 -1.085 . . . . 0.0 108.111 174.054 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -68.43 -16.79 64.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.336 0.589 . . . . 0.0 110.716 -178.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.476 ' H ' HG23 ' A' ' 85' ' ' THR . 40.3 mp0 -77.64 -5.48 50.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.553 176.413 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 114.69 -174.38 15.39 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.188 -0.529 . . . . 0.0 112.652 177.163 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -65.85 119.75 6.82 Favored 'Trans proline' 0 N--CA 1.463 -0.274 0 C-N-CA 123.037 2.491 . . . . 0.0 111.18 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 3.0 m -133.25 179.91 3.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.921 0.391 . . . . 0.0 111.528 -172.239 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.57 146.41 50.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.821 177.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.896 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -86.3 -37.52 18.45 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.327 175.424 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -150.57 -87.29 0.07 Allowed 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 120.929 0.395 . . . . 0.0 111.601 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 4.7 mt -92.94 131.27 40.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.563 -169.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.6 p -100.14 132.1 46.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.511 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.605 ' HB3' ' SG ' ' A' ' 35' ' ' CYS . . . -154.33 167.12 31.03 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 120.834 0.35 . . . . 0.0 111.449 -177.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.79 126.35 52.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.019 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.828 ' HB3' ' HD2' ' A' ' 69' ' ' LYS . 11.5 t -135.93 134.35 20.42 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.137 -171.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -82.78 142.75 11.49 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 122.898 2.398 . . . . 0.0 113.042 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -81.23 125.44 30.3 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 169.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 134.72 -113.37 1.13 Allowed Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -175.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -146.85 105.49 3.82 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 117.136 0.468 . . . . 0.0 111.874 179.279 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 171.73 168.64 0.1 Allowed 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 124.813 1.245 . . . . 0.0 108.764 172.433 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -80.07 171.45 15.07 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.418 -178.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.4 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.04 143.39 43.13 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.272 -178.822 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.467 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 3.7 m -95.26 136.54 25.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.712 -177.072 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.549 ' HB2' HD11 ' A' ' 59' ' ' LEU . . . -111.07 124.14 51.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.058 0.456 . . . . 0.0 111.135 -177.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -105.89 11.27 8.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.273 -178.141 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.7 t70 . . . . . 0 C--N 1.321 -0.643 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.003 179.575 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.463 HD11 ' HD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.412 0 CA-C-O 121.307 0.575 . . . . 0.0 109.671 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -155.66 -46.81 0.08 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.09 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.95 -22.01 60.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.142 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.409 ' HB3' ' O ' ' A' ' 89' ' ' PRO . 0.0 OUTLIER -78.68 64.07 3.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.289 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.39 -31.88 70.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.225 0.536 . . . . 0.0 110.409 178.103 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.41 ' HB2' ' CD ' ' A' ' 87' ' ' GLU . . . -65.76 -31.48 72.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.147 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.463 ' HD2' HD11 ' A' ' 12' ' ' LEU . 60.2 t80 -66.38 -40.51 89.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.016 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.67 -27.29 50.81 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.144 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -55.67 -43.25 76.17 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.575 0.702 . . . . 0.0 109.212 173.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.435 ' OE1' ' HA ' ' A' ' 18' ' ' PHE . 1.3 mt-30 -56.4 -49.0 75.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.346 -1.297 . . . . 0.0 111.147 175.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.53 ' HB1' HD11 ' A' ' 32' ' ' ILE . . . -82.92 0.61 43.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.137 -173.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -78.1 -15.08 59.2 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.753 0.311 . . . . 0.0 110.662 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.73 -8.75 55.55 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.93 -0.653 . . . . 0.0 111.806 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.31 173.95 6.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.509 0.195 . . . . 0.0 110.553 -179.171 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.21 97.11 5.44 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.939 0.4 . . . . 0.0 110.949 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.507 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -143.25 155.13 44.42 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.238 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -95.17 170.09 9.64 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.628 0.251 . . . . 0.0 110.635 -176.091 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.8 p -68.02 126.94 28.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 110.126 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.38 -33.63 5.03 Favored Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -176.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -94.23 25.97 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.218 0.532 . . . . 0.0 110.324 177.563 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.53 HD11 ' HB1' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -112.68 130.17 66.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.113 179.783 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.74 ' HB3' ' SG ' ' A' ' 98' ' ' CYS . . . -149.75 -179.63 7.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.686 0.755 . . . . 0.0 112.524 -172.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.9 t -123.42 132.96 54.11 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.245 175.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.446 ' HB2' HG12 ' A' ' 94' ' ' ILE . 3.9 m -100.36 121.29 41.27 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -113.56 148.0 36.94 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.469 -177.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.441 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 45.4 m -54.1 131.13 59.67 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.437 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.451 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 51.9 Cg_exo -53.27 -37.97 81.32 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.489 2.793 . . . . 0.0 114.157 -171.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.64 -18.02 65.15 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.898 0.38 . . . . 0.0 111.915 -175.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -102.43 -38.86 7.4 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.411 ' O ' HD22 ' A' ' 47' ' ' LEU . 1.8 m -62.49 -30.02 70.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.657 175.405 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.7 OUTLIER -104.72 13.3 31.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.045 -179.655 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -61.23 -42.3 98.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.336 0.589 . . . . 0.0 110.556 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.933 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 30.3 t0 -96.09 130.4 43.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.6 m -69.51 -23.78 63.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.091 0.472 . . . . 0.0 110.315 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -33.39 62.36 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.199 174.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.933 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -64.48 -32.39 74.0 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.416 178.974 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.463 ' HA ' HD21 ' A' ' 51' ' ' LEU . 4.2 t -61.65 -22.04 64.93 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.138 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -106.5 -9.87 30.28 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.439 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.699 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 1.1 mp -82.9 -23.33 33.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.921 0.391 . . . . 0.0 110.574 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.463 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.5 OUTLIER -77.34 -29.03 53.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.094 0.474 . . . . 0.0 110.33 176.503 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -98.43 83.37 0.65 Allowed Glycine 0 N--CA 1.441 -1.015 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.004 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -77.41 -6.64 54.12 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.397 0.618 . . . . 0.0 109.944 177.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.3 -126.14 1.27 Allowed Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.023 176.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.431 ' HB2' HG23 ' A' ' 102' ' ' THR . 0.0 OUTLIER -107.66 55.35 0.65 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.291 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.744 HD11 ' HZ1' ' A' ' 69' ' ' LYS . 3.3 mt -79.92 169.73 17.48 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.786 -172.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.462 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 19.4 t-20 -131.59 -179.45 5.39 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.94 175.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.579 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -99.81 -133.24 8.03 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.847 -175.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.801 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 7.9 tp -80.23 152.64 29.0 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.05 89.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.188 0.518 . . . . 0.0 111.152 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.27 -2.27 57.7 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.7 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.801 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 47.4 t30 -124.86 102.28 7.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.018 0.437 . . . . 0.0 110.877 -178.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.42 73.98 6.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.15 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.58 -55.73 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.909 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.64 79.47 4.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.03 0.443 . . . . 0.0 110.823 178.431 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.579 ' HA ' ' HA2' ' A' ' 58' ' ' GLY . . . -74.72 124.89 27.58 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 173.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.8 m -110.62 128.79 55.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.11 0.481 . . . . 0.0 110.271 -175.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.726 ' HB3' HD22 ' A' ' 81' ' ' LEU . . . -106.21 144.65 32.61 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.804 -174.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.744 ' HZ1' HD11 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -103.51 -174.92 2.66 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.38 -175.424 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.71 -28.57 63.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.565 -178.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -63.95 -42.31 97.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.468 0.651 . . . . 0.0 110.233 177.945 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.474 ' CB ' ' HB1' ' A' ' 68' ' ' ALA . 0.8 OUTLIER -77.26 -35.89 54.87 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.823 -179.95 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.417 HG12 HG21 ' A' ' 82' ' ' VAL . 3.5 mt -65.54 -37.25 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.358 -179.213 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -72.91 -41.32 64.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.929 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 71' ' ' SER . 0.4 OUTLIER -76.4 -53.19 8.51 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.328 -173.468 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.484 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -106.19 -44.52 4.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.25 -172.839 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.94 50.24 7.07 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.194 -1.003 . . . . 0.0 112.504 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.59 106.01 0.72 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 122.332 0.253 . . . . 0.0 111.362 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.6 OUTLIER -71.01 -6.53 39.61 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.891 -177.228 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -86.74 -13.75 44.36 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.906 0.384 . . . . 0.0 110.387 177.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.726 HD22 ' HB3' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -108.62 -33.96 6.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.083 -176.331 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.417 HG21 HG12 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -108.46 137.32 40.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.69 179.805 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.431 ' O ' ' HA ' ' A' ' 89' ' ' PRO . 11.3 t70 -98.18 176.01 5.88 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 175.236 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.91 112.19 7.32 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.946 0.403 . . . . 0.0 111.285 -175.13 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.473 ' HB ' ' OE1' ' A' ' 86' ' ' GLU . 1.2 p -118.82 -167.64 1.41 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.802 177.042 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.473 ' OE1' ' HB ' ' A' ' 85' ' ' THR . 0.0 OUTLIER -66.16 -33.27 75.39 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 177.588 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.41 ' CD ' ' HB2' ' A' ' 17' ' ' ALA . 28.0 mt-10 -80.02 4.8 15.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.437 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 103.8 -155.48 17.75 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.764 173.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.431 ' HA ' ' O ' ' A' ' 83' ' ' ASP . 73.2 Cg_endo -73.4 126.13 10.73 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.876 2.384 . . . . 0.0 111.27 177.559 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -133.12 175.07 12.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.29 -173.137 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.07 116.96 9.29 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.997 178.508 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.5 tttp -76.19 -25.11 54.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.279 0.562 . . . . 0.0 110.433 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -133.02 -106.21 0.25 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.861 -176.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.446 HG12 ' HB2' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -113.69 149.11 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.831 0.348 . . . . 0.0 111.042 -174.18 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 1.5 t -80.87 144.75 10.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.556 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -154.2 170.2 21.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.03 0.443 . . . . 0.0 111.763 -177.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.507 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.6 m -124.33 108.42 12.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.0 177.244 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.74 ' SG ' ' HB3' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -127.85 141.71 42.0 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.243 -174.017 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -87.81 154.57 7.38 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.165 2.576 . . . . 0.0 113.099 -179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.45 ' CD ' ' HZ2' ' A' ' 69' ' ' LYS . 3.6 tp10 -98.26 117.62 33.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.401 173.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 145.06 -67.78 0.42 Allowed Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.008 177.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.431 HG23 ' HB2' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -157.4 177.33 11.55 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.561 HG22 ' H ' ' A' ' 104' ' ' ASN . 1.4 m 69.79 167.59 0.29 Allowed 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.603 0.716 . . . . 0.0 111.919 177.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.561 ' H ' HG22 ' A' ' 103' ' ' THR . 4.5 p30 -89.88 -179.29 5.69 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.542 -171.617 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 98' ' ' CYS . 7.2 t -112.79 148.69 34.29 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.745 -175.725 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.0 m -104.26 138.34 29.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.953 0.406 . . . . 0.0 110.204 178.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.86 117.79 27.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.817 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -121.49 26.41 3.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.953 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.1 t70 . . . . . 0 C--O 1.235 0.33 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.006 176.892 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.374 0 CA-C-O 121.434 0.635 . . . . 0.0 109.97 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.04 -8.7 59.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.608 -177.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.48 6.82 8.94 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.929 0.395 . . . . 0.0 111.559 -177.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 m -61.97 -50.6 71.46 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.422 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 60.72 -73.44 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.743 0.652 . . . . 0.0 112.071 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.5 -28.66 69.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.566 -178.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -62.9 -38.61 91.63 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.183 0.516 . . . . 0.0 110.257 176.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -71.58 -22.06 61.78 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.837 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.468 ' HA ' ' HG2' ' A' ' 23' ' ' GLU . 16.9 mtpp -75.65 -22.25 56.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.723 0.773 . . . . 0.0 109.052 178.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -82.3 -41.95 19.45 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.522 173.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.44 ' HB1' HD11 ' A' ' 32' ' ' ILE . . . -74.69 -17.34 60.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.988 -1.005 . . . . 0.0 112.266 -175.52 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.468 ' HG2' ' HA ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -77.17 -9.2 58.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.675 0.274 . . . . 0.0 111.039 179.228 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.72 -20.04 58.8 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.669 -0.776 . . . . 0.0 112.216 177.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -125.48 123.29 38.88 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.15 97.67 1.23 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.268 0.556 . . . . 0.0 111.945 -176.04 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.3 m -140.85 152.52 45.18 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 173.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -84.2 153.93 23.36 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -173.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.05 -40.99 84.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -176.01 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.0 -8.86 86.95 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.528 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.1 10.06 12.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.033 0.444 . . . . 0.0 110.803 -178.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.44 HD11 ' HB1' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -90.24 137.94 20.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.626 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . . . -149.64 -178.69 6.58 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -170.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.533 ' HB3' ' HB2' ' A' ' 81' ' ' LEU . 4.4 t -144.43 142.15 30.11 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.278 173.818 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.844 ' HB2' ' HB ' ' A' ' 94' ' ' ILE . 78.6 m -113.86 158.32 21.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.839 0.352 . . . . 0.0 110.401 179.259 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -145.26 150.72 37.17 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -42.96 139.45 2.15 Favored Pre-proline 0 C--O 1.235 0.33 0 O-C-N 123.733 0.646 . . . . 0.0 112.436 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.517 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 70.4 Cg_exo -51.22 -54.6 5.13 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.596 2.864 . . . . 0.0 113.881 -172.498 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.9 -7.7 23.9 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -172.672 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -100.56 -51.36 3.63 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.771 0.32 . . . . 0.0 110.718 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.487 HG23 HD21 ' A' ' 51' ' ' LEU . 1.3 m -68.35 -33.3 74.03 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.388 0.613 . . . . 0.0 110.606 178.338 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.517 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.3 m-80 -101.34 14.38 32.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.654 -178.4 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -61.31 -41.91 97.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.379 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.835 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 35.5 t70 -94.96 140.27 30.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.558 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -42.05 97.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.183 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.35 -33.55 73.26 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.862 0.363 . . . . 0.0 110.38 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.835 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -59.9 -36.77 77.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.772 177.415 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.34 -23.28 66.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.933 0.396 . . . . 0.0 110.981 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -98.5 -7.02 56.23 Favored Glycine 0 C--N 1.329 0.189 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.496 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.446 HD21 ' HB3' ' A' ' 78' ' ' LEU . 2.6 tt -82.3 -31.25 30.07 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.009 0.433 . . . . 0.0 110.43 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.487 HD21 HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -75.83 -16.23 60.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.881 179.003 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.59 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -113.81 77.99 0.25 Allowed Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 120.957 -0.64 . . . . 0.0 112.225 -176.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.95 54.06 1.51 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.243 0.544 . . . . 0.0 110.412 177.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.01 -117.74 1.04 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 -177.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.9 mt -117.6 49.14 1.25 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.252 0.549 . . . . 0.0 109.778 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.59 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 1.0 OUTLIER -82.72 175.84 9.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.275 -171.362 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.551 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 6.2 t-20 -135.86 -178.79 5.29 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.299 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -111.79 -132.12 5.87 Favored Glycine 0 C--N 1.315 -0.606 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 -177.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.417 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.1 OUTLIER -66.42 149.8 49.86 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 175.684 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.4 m -65.43 89.72 0.1 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.139 0.495 . . . . 0.0 110.957 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.1 -37.24 3.85 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.604 178.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -89.69 98.62 11.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.912 0.387 . . . . 0.0 111.332 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.69 72.16 2.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.152 179.048 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -169.76 -51.37 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 111.188 -0.765 . . . . 0.0 111.188 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.02 77.73 6.7 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.043 0.449 . . . . 0.0 110.533 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.51 142.45 40.88 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.772 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 4.6 m -123.11 148.41 45.7 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.374 -0.531 . . . . 0.0 111.081 -174.195 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 1.021 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -107.59 139.26 42.4 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.27 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.782 ' HE3' HD22 ' A' ' 72' ' ' LEU . 0.0 OUTLIER -94.3 167.38 11.57 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.402 179.763 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.73 -30.69 69.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.058 0.456 . . . . 0.0 110.083 176.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -27.02 68.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.885 176.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.782 HD22 ' HE3' ' A' ' 69' ' ' LYS . 1.1 tp -91.14 -24.9 19.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.893 0.378 . . . . 0.0 110.733 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 76.2 mt -72.75 -29.17 29.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 172.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.11 -12.82 59.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.006 172.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.604 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 1.1 tp-100 -93.97 -45.31 7.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.342 -178.021 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.0 mp -120.28 -41.94 2.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.688 -174.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.61 50.03 3.25 Favored Glycine 0 CA--C 1.515 0.087 0 C-N-CA 120.105 -1.045 . . . . 0.0 112.13 -178.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.472 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -81.56 164.19 22.1 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.699 0.285 . . . . 0.0 111.64 -175.519 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.56 -0.83 9.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.977 -177.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.56 -35.46 68.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -173.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 1.021 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -116.67 27.07 9.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.761 0.315 . . . . 0.0 111.118 -176.734 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.534 HG11 ' HB3' ' A' ' 89' ' ' PRO . 2.0 t -119.21 137.12 54.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.466 178.278 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.912 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 2.6 t70 -124.13 177.4 5.83 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.987 0.422 . . . . 0.0 111.602 -176.167 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -56.82 133.4 54.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.853 -175.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.526 HG21 ' HA ' ' A' ' 89' ' ' PRO . 5.7 t -159.32 150.28 19.78 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.106 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -108.53 -19.57 13.4 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.951 0.405 . . . . 0.0 110.474 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -90.36 -46.44 8.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.463 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.441 ' O ' HG13 ' A' ' 90' ' ' VAL . . . 174.14 149.3 6.97 Favored Glycine 0 N--CA 1.444 -0.798 0 N-CA-C 111.219 -0.752 . . . . 0.0 111.219 -177.496 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.534 ' HB3' HG11 ' A' ' 82' ' ' VAL . 88.8 Cg_exo -45.61 126.85 9.17 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 123.812 3.008 . . . . 0.0 113.393 -173.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.489 HG22 ' HB ' ' A' ' 85' ' ' THR . 8.7 m -127.43 -179.81 3.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.409 -176.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.76 135.06 52.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.069 -177.493 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.912 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.5 tttp -85.77 -28.28 24.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.489 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.412 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -148.21 -92.2 0.08 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -169.696 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.844 ' HB ' ' HB2' ' A' ' 35' ' ' CYS . 8.7 mt -101.16 117.15 46.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.091 -168.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.5 t -73.95 125.99 33.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.231 -0.44 . . . . 0.0 109.971 176.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -154.54 176.6 12.19 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.001 -176.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 53.6 m -128.13 127.57 43.27 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.218 177.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.773 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 19.2 m -120.72 137.37 26.3 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.394 -174.076 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -86.33 155.16 9.41 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 122.428 2.086 . . . . 0.0 111.475 170.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.69 156.04 17.55 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 173.286 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 97.49 -71.55 0.7 Allowed Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.368 -178.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -150.55 172.03 16.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.511 0.196 . . . . 0.0 111.528 -176.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.482 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.2 OUTLIER 74.48 168.04 0.29 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.644 0.778 . . . . 0.0 113.052 172.076 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.551 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.4 OUTLIER -95.35 178.37 5.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.79 -1.095 . . . . 0.0 112.145 -170.239 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 4.4 m -112.89 142.65 45.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.875 -176.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -90.76 148.99 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 174.627 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -107.04 140.98 38.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.595 0.236 . . . . 0.0 111.098 -176.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -129.81 20.45 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.826 0.346 . . . . 0.0 111.266 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.377 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 176.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.532 ' HB2' ' OG ' ' A' ' 15' ' ' SER . 5.0 mp . . . . . 0 N--CA 1.465 0.285 0 CA-C-O 120.589 0.233 . . . . 0.0 110.564 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.53 38.73 30.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.249 -179.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 58.76 50.14 9.14 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.68 -174.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.558 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 0.5 OUTLIER -51.99 -52.54 49.84 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.597 -176.408 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.3 -56.64 0.44 Allowed 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.575 0.75 . . . . 0.0 111.599 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.9 -35.71 81.39 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.017 0.437 . . . . 0.0 110.919 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -68.87 -25.12 64.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.479 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.51 -24.24 60.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.458 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -67.98 -29.8 68.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 176.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.29 -27.66 59.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.406 -1.27 . . . . 0.0 110.519 177.274 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.12 -18.83 62.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.682 -176.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.06 -8.11 13.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.029 0.442 . . . . 0.0 110.563 175.046 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -83.44 -24.94 49.22 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.496 -0.859 . . . . 0.0 111.116 175.037 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.38 135.01 48.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -74.73 96.91 3.12 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.017 0.437 . . . . 0.0 111.592 -176.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 60.9 m -145.47 136.05 24.27 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 175.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -69.14 144.41 53.86 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.471 -0.196 . . . . 0.0 110.471 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.4 HG23 ' H ' ' A' ' 29' ' ' VAL . 1.6 t -62.95 -36.67 76.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.691 0.282 . . . . 0.0 111.255 -178.156 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.54 -7.98 88.0 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.999 -0.619 . . . . 0.0 112.289 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.21 38.72 3.13 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.948 0.404 . . . . 0.0 110.133 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.5 tt -99.06 134.43 38.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.523 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -147.97 171.54 15.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.127 0.489 . . . . 0.0 111.585 -172.09 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.466 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 2.0 t -120.28 145.65 46.87 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.076 172.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -128.68 157.61 40.87 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -176.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.47 ' HB2' ' CD1' ' A' ' 81' ' ' LEU . 10.6 t-20 -151.26 160.42 43.82 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 -177.272 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.52 146.79 23.01 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.011 176.103 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.604 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 10.7 Cg_endo -54.08 -38.13 87.09 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.154 2.569 . . . . 0.0 112.976 -176.198 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.5 -13.97 62.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.966 0.413 . . . . 0.0 111.717 -175.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -103.39 -50.11 3.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.638 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 22.7 m -59.76 -36.83 77.46 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.795 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.604 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.9 m-80 -104.8 16.93 25.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.029 -176.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -56.03 -27.68 54.2 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.725 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.993 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 12.2 t70 -116.17 133.28 56.19 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 172.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 17.2 m -66.88 -21.21 66.01 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -176.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.1 tp -91.09 -25.3 19.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.245 0.545 . . . . 0.0 110.12 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.993 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 3.1 tp -61.57 -37.63 84.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.47 -177.005 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.623 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -64.64 -20.14 66.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.91 -177.084 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -95.96 -9.73 56.95 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.045 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.587 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 2.0 mp -85.82 -26.07 25.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.825 0.345 . . . . 0.0 111.154 -177.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.623 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.3 OUTLIER -80.03 -11.11 59.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.939 0.4 . . . . 0.0 111.744 -175.646 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.637 ' HA3' ' CB ' ' A' ' 56' ' ' LEU . . . -128.05 91.28 0.34 Allowed Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.808 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.412 ' H ' HD21 ' A' ' 72' ' ' LEU . . . -77.91 74.68 4.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.258 0.551 . . . . 0.0 110.648 -178.248 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 159.49 -69.53 0.25 Allowed Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.136 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.2 tp -136.54 -40.72 0.63 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.637 ' CB ' ' HA3' ' A' ' 52' ' ' GLY . 0.1 OUTLIER 69.13 134.34 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 122.435 1.112 . . . . 0.0 112.672 178.603 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.565 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 8.8 t-20 -141.44 -178.8 5.79 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 114.202 -1.363 . . . . 0.0 107.9 171.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.692 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -114.97 -145.44 8.71 Favored Glycine 0 C--N 1.312 -0.768 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.62 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.468 ' HB3' ' HB2' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -65.2 156.28 32.33 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.469 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.7 m -52.28 101.94 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.099 0.476 . . . . 0.0 111.726 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 74.67 18.63 80.04 Favored Glycine 0 C--N 1.338 0.663 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.529 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.468 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 4.1 t30 -123.29 94.52 4.28 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.866 0.365 . . . . 0.0 110.795 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.06 99.67 7.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.065 0.459 . . . . 0.0 111.051 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 155.7 -55.37 0.41 Allowed Glycine 0 CA--C 1.508 -0.348 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 177.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.78 84.15 6.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.954 0.407 . . . . 0.0 109.999 175.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.692 ' HA ' ' HA2' ' A' ' 58' ' ' GLY . . . -90.54 150.81 21.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.936 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 m -124.26 136.34 54.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.972 0.415 . . . . 0.0 111.195 -174.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -105.63 139.23 40.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.95 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -95.54 168.24 10.81 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.732 -173.885 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.49 -33.32 73.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.047 0.451 . . . . 0.0 111.026 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -31.01 71.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.331 0.586 . . . . 0.0 110.173 177.313 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.458 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.0 OUTLIER -79.73 -21.65 44.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.686 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.94 -41.5 89.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.368 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -90.22 -0.44 57.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.461 . . . . 0.0 110.746 179.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -94.79 -52.95 4.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.535 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.587 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 1.1 mm? -118.67 -46.22 2.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.131 -177.082 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 101.97 52.54 1.01 Allowed Glycine 0 CA--C 1.519 0.315 0 C-N-CA 119.724 -1.227 . . . . 0.0 113.388 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.491 ' HG ' ' HB3' ' A' ' 51' ' ' LEU . 3.9 mm? -64.48 92.34 0.09 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.989 0.424 . . . . 0.0 111.736 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.8 -11.65 60.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.686 -178.564 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.24 -15.46 46.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.174 0.511 . . . . 0.0 110.621 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.47 ' CD1' ' HB2' ' A' ' 36' ' ' ASN . 0.0 OUTLIER -108.37 -16.35 14.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.622 -176.258 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.33 137.85 46.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.187 0.518 . . . . 0.0 110.976 -178.037 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.636 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 3.2 t70 -113.85 176.91 4.83 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 176.093 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -135.19 124.7 24.99 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -171.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.15 -169.34 1.63 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.988 -1.006 . . . . 0.0 108.962 171.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.02 -29.15 61.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.849 0.357 . . . . 0.0 110.778 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.558 ' HB3' ' O ' ' A' ' 15' ' ' SER . 35.3 mp0 -76.6 -14.52 59.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.621 -178.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 135.51 -165.52 24.73 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 119.964 -1.113 . . . . 0.0 112.728 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -74.49 125.6 9.71 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.88 2.386 . . . . 0.0 111.802 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -124.15 -177.96 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.079 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.28 129.93 40.65 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 178.495 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.636 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 11.8 tttp -79.74 -27.69 40.54 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.639 -176.286 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -155.02 -90.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -172.28 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.415 HD12 ' HA ' ' A' ' 36' ' ' ASN . 5.2 mt -95.63 138.66 20.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.002 -171.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.6 t -101.67 123.09 54.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.586 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.15 157.92 43.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.909 -177.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.36 124.26 49.25 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 177.507 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.442 ' CA ' ' HB3' ' A' ' 105' ' ' CYS . 8.3 t -135.45 133.03 20.12 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.188 -171.172 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.409 ' O ' ' HD2' ' A' ' 69' ' ' LYS . 36.9 Cg_endo -65.84 171.77 9.35 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.755 2.304 . . . . 0.0 111.683 174.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.63 -82.49 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -171.201 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -128.02 0.76 6.67 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.064 -1.065 . . . . 0.0 113.413 -174.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.03 142.32 51.57 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.682 0.241 . . . . 0.0 111.511 -175.006 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 6.3 m 73.59 157.32 0.19 Allowed 'General case' 0 CA--C 1.532 0.286 0 O-C-N 123.882 0.739 . . . . 0.0 112.304 175.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.565 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.7 OUTLIER -73.11 168.9 18.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.762 -175.374 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.442 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -113.22 141.82 46.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.027 -179.403 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -83.3 145.99 7.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.065 174.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.94 115.69 23.02 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.458 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -85.89 -8.63 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-O 121.837 0.827 . . . . 0.0 110.071 177.563 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.308 -1.222 0 CA-C-N 114.315 -1.311 . . . . 0.0 108.512 176.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.469 0.506 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.3 -34.86 78.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.709 0.29 . . . . 0.0 111.39 179.028 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.71 -20.15 47.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.81 0.338 . . . . 0.0 111.641 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.684 ' HA ' ' O ' ' A' ' 87' ' ' GLU . 0.3 OUTLIER -76.19 68.15 2.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.211 0.529 . . . . 0.0 111.317 179.295 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.75 -19.9 66.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.851 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -82.04 -26.89 33.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.503 177.402 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.553 ' O ' ' HB2' ' A' ' 21' ' ' GLN . 41.2 t80 -82.73 -41.55 19.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.758 -178.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.76 -18.91 61.66 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.7 mttp -67.33 -18.01 64.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.014 0.435 . . . . 0.0 110.533 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.553 ' HB2' ' O ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -63.69 -28.1 69.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.562 177.927 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.05 -18.56 62.56 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.406 -178.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -98.35 -41.53 7.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.487 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -66.41 -30.33 76.39 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.679 177.122 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.601 HG21 HG21 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -133.62 123.02 24.32 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 176.241 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.79 97.64 1.82 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.02 0.438 . . . . 0.0 111.464 -176.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.465 ' HB2' HD12 ' A' ' 32' ' ' ILE . 79.8 m -139.51 -178.43 5.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.653 179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.701 ' H ' ' HB2' ' A' ' 31' ' ' SER . 30.0 t-20 -122.03 176.61 5.71 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 -176.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.43 HG23 ' H ' ' A' ' 30' ' ' GLY . 2.5 m -52.76 -53.49 20.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -178.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.43 ' H ' HG23 ' A' ' 29' ' ' VAL . . . -89.41 20.62 33.21 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.961 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.701 ' HB2' ' H ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -123.61 -12.2 7.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.849 0.357 . . . . 0.0 110.839 177.044 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.465 HD12 ' HB2' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -82.22 127.26 39.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 175.684 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.72 153.99 38.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.152 0.501 . . . . 0.0 111.462 -174.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.433 ' O ' HD13 ' A' ' 81' ' ' LEU . 11.5 t -122.7 143.06 50.04 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.628 176.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -127.54 163.83 23.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.605 0.716 . . . . 0.0 110.985 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.462 ' HB2' ' HA ' ' A' ' 81' ' ' LEU . 20.2 t-20 -136.14 160.82 37.51 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.19 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -45.8 137.07 5.99 Favored Pre-proline 0 C--N 1.329 -0.292 0 O-C-N 123.588 0.555 . . . . 0.0 110.457 177.431 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.496 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 79.7 Cg_exo -48.54 -36.84 32.58 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 123.254 2.636 . . . . 0.0 113.351 -175.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.02 -7.82 50.99 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -177.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.4 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 0.9 OUTLIER -109.18 -41.78 4.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.127 0.489 . . . . 0.0 109.86 178.551 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.437 HG21 ' HB3' ' A' ' 66' ' ' ALA . 29.0 m -65.45 -37.05 85.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.671 175.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.496 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.3 m-80 -100.27 15.31 28.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.707 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.4 ' HB2' ' HA ' ' A' ' 40' ' ' GLU . 10.1 t-20 -65.11 -32.75 74.61 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.474 -176.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.931 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.6 t70 -104.8 146.6 28.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.636 178.277 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.86 -36.94 75.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.002 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.3 tp -86.47 -20.89 27.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.134 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.931 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -53.73 -47.54 70.49 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.109 0.481 . . . . 0.0 111.203 179.047 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.59 -18.24 65.26 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.22 -178.304 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -93.98 -29.13 10.04 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.737 176.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.457 HD22 ' HG ' ' A' ' 76' ' ' LEU . 27.9 mt -74.11 -24.53 59.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 176.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.444 ' HA ' HD13 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -55.67 -51.8 66.02 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.691 173.219 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -87.02 74.23 2.35 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.842 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -100.9 32.92 2.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.593 0.711 . . . . 0.0 109.334 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 160.73 -111.88 0.5 Allowed Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.51 -174.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.567 HD12 ' HA2' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -117.15 72.33 0.83 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.364 0.602 . . . . 0.0 110.392 176.896 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.66 ' HG ' ' HZ2' ' A' ' 69' ' ' LYS . 1.5 mp -123.44 134.1 53.98 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.253 178.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -128.42 -177.34 4.13 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.297 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.72 -162.83 35.06 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.617 -0.802 . . . . 0.0 113.073 -173.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.402 HD23 ' HB2' ' A' ' 65' ' ' SER . 0.4 OUTLIER -65.35 158.2 27.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.508 0.194 . . . . 0.0 110.494 -179.679 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.968 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -61.07 88.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.464 0.65 . . . . 0.0 112.283 -177.638 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.03 4.1 78.76 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.454 -0.794 . . . . 0.0 113.11 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.4 t30 -117.66 134.6 54.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 117.123 0.461 . . . . 0.0 111.422 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.0 125.99 47.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.407 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.11 -49.37 0.93 Allowed Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.856 -0.687 . . . . 0.0 111.752 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.402 ' HB2' HD23 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -82.56 115.5 21.57 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 175.946 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.437 ' HB3' HG21 ' A' ' 41' ' ' THR . . . -127.77 147.34 50.41 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.265 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.9 m -121.08 135.63 55.15 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.909 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.806 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -105.82 152.45 23.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 176.491 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.66 ' HZ2' ' HG ' ' A' ' 56' ' ' LEU . 0.0 OUTLIER -111.62 -177.2 3.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.385 -176.956 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.3 -24.5 67.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.073 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -66.77 -31.02 71.38 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.417 0.627 . . . . 0.0 110.027 178.773 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.481 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -90.43 -33.72 15.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.709 179.632 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.1 mt -65.87 -39.45 84.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.597 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -84.48 -2.97 58.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.899 0.381 . . . . 0.0 110.841 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -94.75 -53.31 3.91 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.052 0.453 . . . . 0.0 110.823 178.38 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.468 ' HA ' HD13 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -126.28 -28.57 3.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.804 -175.339 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.04 50.69 4.49 Favored Glycine 0 C--O 1.228 -0.274 0 C-N-CA 120.343 -0.932 . . . . 0.0 111.929 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.6 mt -59.19 96.15 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.766 0.426 . . . . 0.0 111.944 -176.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.435 ' HG ' ' H ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -79.17 6.26 10.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.414 -177.15 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.97 -26.47 64.11 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.255 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.806 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -129.9 2.1 4.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.714 -176.292 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 39.0 t -111.69 138.25 41.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.12 0.486 . . . . 0.0 110.97 -175.25 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 3.3 t70 -123.87 177.31 5.81 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.427 176.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -136.2 137.74 41.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.048 0.451 . . . . 0.0 112.202 -172.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -135.56 -169.3 2.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.669 174.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -42.93 99.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.145 0.497 . . . . 0.0 109.968 177.67 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.684 ' O ' ' HA ' ' A' ' 15' ' ' SER . 3.1 mp0 -81.57 43.29 0.74 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.47 -179.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 80.89 -170.37 52.97 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.974 -0.557 . . . . 0.0 113.52 173.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.452 ' O ' ' HB3' ' A' ' 15' ' ' SER . 11.0 Cg_exo -70.84 134.5 25.84 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 123.072 2.514 . . . . 0.0 111.369 174.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.46 ' HB ' ' H ' ' A' ' 91' ' ' CYS . 0.6 OUTLIER -132.81 -153.6 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.66 -174.965 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.46 ' H ' ' HB ' ' A' ' 90' ' ' VAL . 0.5 OUTLIER -94.45 152.87 18.26 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.428 -178.036 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.433 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 1.1 tttt -92.92 -34.82 13.63 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.29 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -159.12 -62.4 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.186 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.416 HG23 ' HB3' ' A' ' 109' ' ' ASP . 33.3 mt -112.27 132.6 60.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.905 0.383 . . . . 0.0 111.809 -171.114 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.459 HG22 HG23 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -105.16 139.02 27.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.489 175.824 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.417 ' CB ' ' HA ' ' A' ' 107' ' ' ALA . . . -149.94 167.57 26.29 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 121.22 0.534 . . . . 0.0 111.859 -176.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 4.2 t -112.46 114.71 27.54 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.103 176.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.632 ' O ' ' HA ' ' A' ' 31' ' ' SER . 46.8 t -135.05 106.72 10.39 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.799 -174.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.665 ' HD2' HG21 ' A' ' 102' ' ' THR . 25.9 Cg_exo -67.54 144.83 68.34 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.958 2.439 . . . . 0.0 112.251 173.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.32 72.03 3.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.494 0.664 . . . . 0.0 109.802 171.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.567 ' HA2' HD12 ' A' ' 55' ' ' LEU . . . 145.11 63.46 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.313 -177.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.665 HG21 ' HD2' ' A' ' 99' ' ' PRO . 12.0 t -148.29 156.69 42.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.943 0.401 . . . . 0.0 111.061 -176.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -38.54 87.18 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.521 177.367 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.968 ' HB2' ' HA ' ' A' ' 60' ' ' SER . 0.2 OUTLIER -155.14 159.49 40.22 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.735 176.589 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.461 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 1.8 m -111.63 140.39 46.28 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 176.659 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -96.74 136.81 26.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.235 0.541 . . . . 0.0 111.477 -175.131 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.417 ' HA ' ' CB ' ' A' ' 96' ' ' ALA . . . -90.83 130.04 36.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.924 176.533 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.601 HG21 HG21 ' A' ' 25' ' ' THR . 0.0 OUTLIER -95.22 -6.26 10.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.423 0.63 . . . . 0.0 111.013 -179.004 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ASP . . . . . 0.416 ' HB3' HG23 ' A' ' 94' ' ' ILE . 2.7 t70 . . . . . 0 C--N 1.316 -0.861 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.389 175.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.445 ' HB2' ' HB3' ' A' ' 15' ' ' SER . 5.2 mp . . . . . 0 CA--C 1.529 0.163 0 CA-C-O 120.014 -0.041 . . . . 0.0 110.983 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 36.82 74.05 0.08 Allowed 'General case' 0 N--CA 1.472 0.636 0 O-C-N 124.144 0.903 . . . . 0.0 112.986 175.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.27 62.71 1.14 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.602 0.715 . . . . 0.0 111.083 -177.451 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.445 ' HB3' ' HB2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -85.25 49.69 1.8 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.135 -177.316 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.413 ' HB3' ' OE1' ' A' ' 87' ' ' GLU . . . -67.67 -51.44 49.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.49 -33.08 70.89 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.479 176.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.606 ' HB2' HG12 ' A' ' 90' ' ' VAL . 23.7 t80 -70.25 -47.1 62.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.056 0.455 . . . . 0.0 110.335 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.8 -23.98 64.35 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.915 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -67.9 -25.08 65.31 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.847 0.832 . . . . 0.0 109.254 177.39 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -93.11 -38.16 11.75 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.409 -1.268 . . . . 0.0 110.601 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.73 -17.81 64.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.97 -176.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.62 -8.02 57.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.939 0.399 . . . . 0.0 110.677 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.31 1.72 37.45 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.802 -0.714 . . . . 0.0 111.44 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.433 HG21 ' HB ' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -114.65 124.55 52.12 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.297 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.43 94.59 2.1 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.08 0.467 . . . . 0.0 111.06 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 27.7 m -151.85 -177.53 6.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.036 179.052 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -112.7 151.32 30.36 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 176.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.9 t -58.29 -40.89 79.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.917 0.389 . . . . 0.0 111.066 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.51 8.33 54.58 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.486 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -143.58 32.46 1.3 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.944 0.402 . . . . 0.0 110.312 178.152 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.9 134.86 31.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.503 ' CB ' ' HB3' ' A' ' 98' ' ' CYS . . . -149.2 170.88 17.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.254 0.549 . . . . 0.0 111.974 -175.238 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.2 t -118.26 141.87 48.07 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.829 173.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -126.17 156.29 40.39 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.398 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.456 ' HA ' HD12 ' A' ' 94' ' ' ILE . 56.0 t30 -156.2 160.37 39.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.172 178.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.597 ' HB2' ' OE1' ' A' ' 40' ' ' GLU . 1.5 m -59.61 148.45 74.64 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.069 -177.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.63 ' HA ' HG22 ' A' ' 41' ' ' THR . 32.4 Cg_endo -65.79 -26.72 52.37 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.031 2.488 . . . . 0.0 113.424 -175.662 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.23 -11.92 58.71 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.142 0.496 . . . . 0.0 111.312 -176.072 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.597 ' OE1' ' HB2' ' A' ' 37' ' ' SER . 1.9 mp0 -108.17 -51.03 2.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.229 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.63 HG22 ' HA ' ' A' ' 38' ' ' PRO . 1.2 t -69.63 -20.56 63.6 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.296 -176.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.582 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.5 m120 -105.47 3.46 29.55 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 -178.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -71.76 -46.92 56.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.741 0.305 . . . . 0.0 111.386 -176.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 1.046 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 61.1 t0 -75.68 133.6 40.77 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 178.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -23.61 66.94 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.633 178.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.608 ' HG ' HD13 ' A' ' 50' ' ' LEU . 11.3 tp -87.14 -32.6 19.79 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.288 177.298 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 1.046 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -64.52 -34.22 77.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.145 -177.185 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -18.12 64.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.074 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -102.73 -30.44 5.52 Favored Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 111.374 -0.69 . . . . 0.0 111.374 173.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.67 ' HG ' ' HB3' ' A' ' 76' ' ' LEU . 1.9 mp -60.28 -36.45 77.85 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 122.667 0.387 . . . . 0.0 110.992 178.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.8 pp -73.4 -11.25 60.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.005 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.61 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -111.99 66.31 0.24 Allowed Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.227 -178.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.442 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -78.87 66.7 4.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.907 0.384 . . . . 0.0 111.4 -178.339 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 90.43 82.92 1.38 Allowed Glycine 0 C--O 1.226 -0.356 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.04 176.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.5 tp 63.27 20.57 12.35 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.857 0.463 . . . . 0.0 112.029 176.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.789 HD22 ' HA2' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -53.87 145.84 15.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.816 178.089 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -113.24 -178.23 3.33 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.452 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -109.03 -158.28 18.61 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.073 -176.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.74 HD23 ' HB3' ' A' ' 62' ' ' ASN . 1.2 tp -77.5 138.42 39.2 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 120.737 0.303 . . . . 0.0 110.216 178.265 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.6 m -53.34 108.05 0.3 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.444 -175.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.11 -12.87 64.9 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.549 173.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.74 ' HB3' HD23 ' A' ' 59' ' ' LEU . 18.8 t30 -127.92 114.57 17.34 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.321 0.581 . . . . 0.0 110.954 -178.257 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.11 160.08 30.11 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.919 -178.512 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.419 ' C ' ' HB3' ' A' ' 38' ' ' PRO . . . 94.92 -42.45 2.39 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.617 178.1 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.446 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 0.7 OUTLIER -81.98 117.62 22.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.874 0.369 . . . . 0.0 110.48 -178.761 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.16 143.86 34.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.08 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.68 128.69 55.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.028 0.442 . . . . 0.0 110.858 -178.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.529 ' HB2' HD12 ' A' ' 81' ' ' LEU . . . -112.78 129.83 56.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.95 -177.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.774 ' HZ1' HD11 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -95.94 173.27 7.53 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.539 -178.943 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.444 ' HA ' HD13 ' A' ' 73' ' ' ILE . . . -58.24 -29.94 66.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.911 0.386 . . . . 0.0 111.207 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -28.3 68.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.096 178.222 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.657 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 2.0 mp -86.37 -17.71 33.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.061 0.458 . . . . 0.0 110.586 -179.031 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.453 HG13 HG21 ' A' ' 82' ' ' VAL . 0.5 OUTLIER -63.59 -41.53 92.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.969 177.901 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -89.52 -12.83 38.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.271 0.558 . . . . 0.0 110.564 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.657 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.5 OUTLIER -77.04 -53.53 7.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.222 -178.344 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.67 ' HB3' ' HG ' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -125.5 -29.99 3.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.312 -175.824 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.31 48.69 18.1 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 120.302 -0.951 . . . . 0.0 111.999 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.412 ' H ' HD12 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -74.95 97.29 3.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.833 0.349 . . . . 0.0 111.129 -177.716 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.34 8.46 2.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.366 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.28 -27.28 47.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.019 0.438 . . . . 0.0 109.935 174.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.529 HD12 ' HB2' ' A' ' 68' ' ' ALA . 7.9 mt -117.83 -5.62 11.06 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.597 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.453 HG21 HG13 ' A' ' 73' ' ' ILE . 11.6 t -117.46 138.0 49.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.481 178.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -132.49 178.06 7.12 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.079 178.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -136.03 98.89 3.99 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.842 0.353 . . . . 0.0 111.205 -174.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.5 t -82.3 -173.6 4.65 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.866 175.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -78.72 55.36 1.67 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.076 0.465 . . . . 0.0 110.808 -178.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.413 ' OE1' ' HB3' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -161.11 -59.88 0.05 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.854 -178.996 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -171.82 -174.48 39.39 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.811 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.09 121.3 7.92 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.755 2.303 . . . . 0.0 110.76 174.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.606 HG12 ' HB2' ' A' ' 18' ' ' PHE . 2.7 m -136.28 -174.31 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.211 0.529 . . . . 0.0 111.619 -170.208 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.49 130.62 43.62 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.902 177.377 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.1 tttt -71.91 -43.91 64.56 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.012 0.434 . . . . 0.0 110.311 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -149.56 -100.92 0.07 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.257 -173.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.456 HD12 ' HA ' ' A' ' 36' ' ' ASN . 6.7 mt -73.61 126.88 35.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.765 -169.17 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.433 ' HB ' HG21 ' A' ' 25' ' ' THR . 0.1 OUTLIER -89.57 133.14 32.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.242 177.879 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.463 ' HB1' ' O ' ' A' ' 106' ' ' VAL . . . -153.5 167.53 29.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.139 0.495 . . . . 0.0 111.83 -175.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -109.26 132.75 53.82 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 174.741 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.517 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 44.0 t -152.45 135.0 8.99 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-O 120.81 0.338 . . . . 0.0 111.636 -171.081 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.413 ' O ' ' HD2' ' A' ' 69' ' ' LYS . 75.2 Cg_endo -77.29 -177.84 4.14 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 123.411 2.741 . . . . 0.0 111.019 172.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -76.28 -121.59 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -176.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.789 ' HA2' HD22 ' A' ' 56' ' ' LEU . . . -92.52 51.7 2.69 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 121.074 -0.584 . . . . 0.0 112.983 -176.23 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.35 137.23 1.08 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 176.57 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.2 m 72.85 147.69 0.09 Allowed 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.24 0.962 . . . . 0.0 111.653 178.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.09 164.11 27.17 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.857 -177.522 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.517 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.8 OUTLIER -111.12 143.17 42.27 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.696 -179.966 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.463 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 0.9 OUTLIER -100.69 138.7 24.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.057 0.456 . . . . 0.0 110.435 -177.693 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.98 122.93 41.7 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.935 178.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -98.23 14.2 4.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.265 0.555 . . . . 0.0 111.051 -177.288 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 35.8 t0 . . . . . 0 C--N 1.321 -0.641 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.893 174.361 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.401 HD22 ' HA ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.469 0.475 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.84 -33.74 76.35 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.091 0.472 . . . . 0.0 111.016 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -4.7 57.45 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.659 -179.21 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.507 ' HA ' ' HA3' ' A' ' 88' ' ' GLY . 4.1 m -83.26 92.22 7.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.185 -178.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.1 -31.46 67.81 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.33 0.586 . . . . 0.0 109.652 176.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.96 -31.81 72.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.185 176.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.567 ' HD1' ' HA ' ' A' ' 90' ' ' VAL . 22.8 t80 -73.23 -35.0 66.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.246 0.546 . . . . 0.0 109.836 176.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.63 -29.57 68.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.173 0.511 . . . . 0.0 110.463 174.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.1 tttt -66.74 -38.41 86.59 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 174.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.412 ' HG2' HG11 ' A' ' 95' ' ' VAL . 0.8 OUTLIER -61.55 -35.08 76.75 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.849 176.468 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.58 -11.59 60.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.53 -178.646 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.14 -35.04 6.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.137 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.15 -34.37 89.49 Favored Glycine 0 N--CA 1.451 -0.366 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 175.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.22 129.9 55.76 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 174.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.9 m -68.83 98.23 0.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -170.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 98.7 m -144.65 -178.16 5.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.031 -0.986 . . . . 0.0 108.595 174.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -101.17 150.41 22.97 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.191 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.5 -31.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.783 -177.555 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.5 -49.41 5.82 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.545 -0.836 . . . . 0.0 111.023 175.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.443 ' HB3' ' HA ' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -87.56 53.69 2.88 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.345 -0.428 . . . . 0.0 110.738 179.034 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.441 HD12 ' HA ' ' A' ' 32' ' ' ILE . 9.0 tp -108.68 139.52 30.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.936 0.398 . . . . 0.0 110.694 -179.343 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.777 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . . . -150.21 -178.74 6.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.348 0.594 . . . . 0.0 112.003 -177.313 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 48.8 t -133.16 134.41 44.1 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 171.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.447 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 99.3 m -106.53 145.08 32.3 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.018 0.437 . . . . 0.0 110.232 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -139.21 150.87 46.04 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.598 ' HB2' ' OE1' ' A' ' 40' ' ' GLU . 0.3 OUTLIER -42.71 139.08 2.11 Favored Pre-proline 0 CA--C 1.536 0.418 0 O-C-N 123.877 0.736 . . . . 0.0 112.434 179.807 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.461 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 20.3 Cg_endo -59.86 -40.61 61.43 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.561 2.841 . . . . 0.0 114.038 -171.36 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.76 -19.96 65.17 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.22 0.533 . . . . 0.0 111.661 -174.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.598 ' OE1' ' HB2' ' A' ' 37' ' ' SER . 45.3 mp0 -100.37 -39.83 7.79 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.064 -179.09 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 47.4 m -64.93 -35.49 81.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.641 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -104.04 15.7 27.94 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.862 -177.748 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -59.69 -25.59 64.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.986 -174.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 1.052 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 15.2 t70 -121.61 135.28 55.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.476 -177.901 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.77 -35.08 72.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.671 0.272 . . . . 0.0 111.315 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.424 ' HB3' ' OD2' ' A' ' 44' ' ' ASP . 2.6 tp -76.47 -40.52 50.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.99 0.424 . . . . 0.0 110.046 178.086 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 1.052 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 2.7 tp -56.74 -42.94 80.15 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.935 176.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.481 ' HA ' HD11 ' A' ' 51' ' ' LEU . 15.9 m -64.75 -9.14 18.07 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.176 -0.466 . . . . 0.0 112.213 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -108.95 -5.08 31.18 Favored Glycine 0 C--O 1.228 -0.235 0 N-CA-C 111.214 -0.754 . . . . 0.0 111.214 174.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.728 ' HG ' HD23 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -84.68 -25.81 28.19 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.546 -0.327 . . . . 0.0 111.287 -176.698 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.604 ' HG ' ' HB1' ' A' ' 66' ' ' ALA . 0.0 OUTLIER -77.4 1.23 19.64 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.448 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -146.52 85.81 0.17 Allowed Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.259 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.56 51.71 0.75 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.266 0.555 . . . . 0.0 110.872 178.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 171.11 -99.9 0.15 Allowed Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.42 ' O ' HG22 ' A' ' 102' ' ' THR . 0.7 OUTLIER -149.21 48.03 0.98 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.63 0.729 . . . . 0.0 109.621 176.159 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.691 HD13 ' HE3' ' A' ' 69' ' ' LYS . 0.2 OUTLIER -87.92 -178.89 6.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.139 -176.842 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.447 ' H ' HD23 ' A' ' 56' ' ' LEU . 1.1 t-20 -140.94 -176.37 4.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.033 -175.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.561 ' HA3' ' HA ' ' A' ' 66' ' ' ALA . . . -113.55 -118.66 3.46 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.289 -175.382 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.426 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -65.45 140.22 58.59 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.62 0.247 . . . . 0.0 110.338 179.409 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.566 ' HA ' ' CB ' ' A' ' 104' ' ' ASN . 64.2 m -62.85 89.89 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.368 -178.256 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.67 -36.42 4.26 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.947 -0.644 . . . . 0.0 112.738 177.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -91.08 101.98 14.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.026 0.441 . . . . 0.0 111.214 -176.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.72 93.54 3.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.993 179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 170.58 -54.28 0.19 Allowed Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.279 -0.729 . . . . 0.0 111.279 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.49 106.72 8.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 174.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.604 ' HB1' ' HG ' ' A' ' 51' ' ' LEU . . . -107.09 154.87 20.52 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.091 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.58 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 4.9 m -135.46 145.69 47.43 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -177.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 1.025 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -105.23 130.45 53.37 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.126 0.488 . . . . 0.0 110.454 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 1.047 ' HD3' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -84.3 161.78 20.32 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.585 -178.757 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.662 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -56.78 -36.3 69.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.743 0.306 . . . . 0.0 111.638 -178.106 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -64.86 -31.05 72.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.486 0.66 . . . . 0.0 110.123 178.38 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.506 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -79.67 -33.51 41.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.564 179.255 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.662 HD12 ' HA ' ' A' ' 70' ' ' ALA . 41.0 mt -66.49 -34.49 70.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.558 177.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -73.5 -40.2 64.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.688 175.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.405 ' HB2' ' O ' ' A' ' 71' ' ' SER . 0.9 OUTLIER -76.54 -55.09 5.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -174.777 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.728 HD23 ' HG ' ' A' ' 50' ' ' LEU . 3.7 mp -109.85 -28.33 8.83 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.915 -0.314 . . . . 0.0 111.133 -173.169 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.402 ' HA2' ' O ' ' A' ' 73' ' ' ILE . . . 82.61 50.43 4.72 Favored Glycine 0 CA--C 1.516 0.15 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.526 173.067 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.538 ' HG ' HD23 ' A' ' 50' ' ' LEU . 4.7 mp -68.04 108.3 3.03 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.108 0.48 . . . . 0.0 111.546 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.511 ' HG ' ' H ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -90.69 12.06 20.24 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.887 178.995 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.04 -26.46 60.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.51 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 1.025 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -119.42 9.75 11.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.52 -175.627 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.4 t -104.62 136.56 37.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.757 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 28.3 t0 -117.13 168.99 9.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.072 0.463 . . . . 0.0 111.746 -176.313 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.8 p-80 -56.96 147.47 23.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.405 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.455 HG21 ' C ' ' A' ' 88' ' ' GLY . 9.5 t -153.96 155.72 36.13 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.118 0.485 . . . . 0.0 111.752 -175.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.13 -0.55 15.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.554 0.692 . . . . 0.0 109.44 174.146 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.439 ' HB3' ' H ' ' A' ' 88' ' ' GLY . 7.6 tm-20 -115.0 -86.33 0.6 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.389 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.507 ' HA3' ' HA ' ' A' ' 15' ' ' SER . . . -141.89 155.04 25.23 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 172.341 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.407 ' N ' HG21 ' A' ' 85' ' ' THR . 82.2 Cg_exo -45.32 119.53 2.63 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.185 2.59 . . . . 0.0 112.094 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.567 ' HA ' ' HD1' ' A' ' 18' ' ' PHE . 1.6 m -120.04 179.85 1.95 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.722 -172.331 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 5.2 t -67.36 130.69 43.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.626 178.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.757 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttp -77.81 -30.43 51.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.578 -177.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -149.09 -89.07 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -171.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 4.9 mt -95.97 122.43 47.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.51 -169.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.428 HG23 ' HB3' ' A' ' 109' ' ' ASP . 0.0 OUTLIER -83.36 128.88 38.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.706 179.329 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.447 ' HB3' ' SG ' ' A' ' 35' ' ' CYS . . . -154.5 170.36 21.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.601 -178.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -115.31 124.0 50.17 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.978 0.418 . . . . 0.0 110.97 179.825 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 1.047 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 3.2 m -114.65 119.56 39.37 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.936 -178.139 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.473 ' O ' HD21 ' A' ' 56' ' ' LEU . 68.6 Cg_endo -75.5 139.74 23.36 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.327 2.018 . . . . 0.0 111.672 174.091 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.29 140.86 40.14 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 174.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 118.15 -91.99 0.53 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.634 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.42 HG22 ' O ' ' A' ' 55' ' ' LEU . 0.3 OUTLIER -141.17 179.32 6.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.674 0.273 . . . . 0.0 111.134 -175.261 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.494 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.2 OUTLIER 65.67 -167.59 0.21 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.383 -0.826 . . . . 0.0 113.045 174.455 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.566 ' CB ' ' HA ' ' A' ' 60' ' ' SER . 80.4 m-20 -98.03 173.3 7.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.656 0.741 . . . . 0.0 112.67 -162.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 29.2 m -112.28 141.71 45.66 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.1 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.4 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 0.9 OUTLIER -95.58 143.57 11.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 120.821 0.343 . . . . 0.0 110.344 178.369 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -105.34 115.29 30.01 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 8.9 p -91.24 0.53 8.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.753 0.787 . . . . 0.0 111.37 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ASP . . . . . 0.428 ' HB3' HG23 ' A' ' 95' ' ' VAL . 28.9 t0 . . . . . 0 C--N 1.314 -0.956 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.857 175.14 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.71 ' HG ' ' OG ' ' A' ' 15' ' ' SER . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.233 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 72.35 -31.0 0.22 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.771 0.829 . . . . 0.0 111.634 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.447 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -149.12 -68.56 0.21 Allowed 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.753 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.71 ' OG ' ' HG ' ' A' ' 12' ' ' LEU . 2.3 m 67.3 -67.95 0.16 Allowed 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.427 0.691 . . . . 0.0 112.555 176.83 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.771 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . 56.8 -87.39 0.02 OUTLIER 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.421 0.688 . . . . 0.0 111.21 -175.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.458 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . . . -71.24 -35.77 71.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.876 0.37 . . . . 0.0 110.614 -179.516 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.497 ' HB2' HG12 ' A' ' 90' ' ' VAL . 19.9 t80 -70.52 -16.71 62.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.618 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.75 -15.45 59.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.963 0.411 . . . . 0.0 110.549 177.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.458 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 3.4 mttt -83.26 -24.35 32.31 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 175.516 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -32.45 72.91 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.241 176.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.27 -17.14 64.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.879 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -101.09 -50.54 3.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.602 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.83 -17.78 69.75 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.704 -178.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.5 m -119.67 134.94 55.02 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.36 97.49 9.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.964 0.412 . . . . 0.0 110.98 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -140.32 -178.19 5.37 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.419 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -120.91 172.2 8.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.568 0.223 . . . . 0.0 110.94 -175.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.408 HG13 ' N ' ' A' ' 30' ' ' GLY . 14.5 p -61.77 -45.58 98.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.76 -175.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.408 ' N ' HG13 ' A' ' 29' ' ' VAL . . . -100.62 20.01 50.04 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.771 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 1.2 m -125.98 -5.58 6.79 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.552 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -80.09 126.45 39.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.425 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.573 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -148.25 160.31 43.08 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.291 0.567 . . . . 0.0 111.966 -170.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 m -114.58 139.23 49.77 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.428 174.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.414 ' HB3' ' HB ' ' A' ' 94' ' ' ILE . 0.5 OUTLIER -124.62 160.16 29.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.838 0.351 . . . . 0.0 110.853 -176.591 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -145.74 160.03 42.31 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.758 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -51.4 150.69 6.12 Favored Pre-proline 0 CA--C 1.536 0.44 0 O-C-N 123.549 0.531 . . . . 0.0 111.321 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 47.2 Cg_exo -53.47 -49.02 18.82 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.082 2.521 . . . . 0.0 113.3 -171.446 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.06 -11.41 60.94 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -174.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' A' ' 43' ' ' ASN . 0.1 OUTLIER -103.27 -43.85 5.33 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.085 0.469 . . . . 0.0 110.035 179.881 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.826 HG21 ' H ' ' A' ' 66' ' ' ALA . 0.6 OUTLIER -65.84 -34.28 77.8 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.147 176.104 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.528 ' ND2' ' HB3' ' A' ' 48' ' ' SER . 1.8 m120 -104.16 14.69 29.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.312 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.429 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 4.5 t-20 -47.58 -38.7 14.95 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.537 -176.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.642 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 9.8 t70 -113.2 142.18 46.09 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.386 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.0 -35.21 74.54 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.231 0.332 . . . . 0.0 111.149 -179.38 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.37 -32.33 58.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.921 0.391 . . . . 0.0 109.954 178.39 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.642 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.6 OUTLIER -61.72 -39.36 91.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.522 -179.128 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.66 ' HA ' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -58.22 -31.38 67.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.478 179.505 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -84.13 -30.31 28.68 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.911 178.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.422 ' HG ' HD13 ' A' ' 76' ' ' LEU . 1.4 mp -69.28 -20.93 63.91 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.815 0.34 . . . . 0.0 111.096 -178.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.66 HD12 ' HA ' ' A' ' 48' ' ' SER . 3.3 mt -74.01 -14.1 60.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.532 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.666 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -126.97 76.42 0.4 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.599 -0.81 . . . . 0.0 111.621 -177.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.91 -20.35 33.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.969 0.414 . . . . 0.0 110.798 -176.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -139.01 68.23 0.5 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.509 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 mt 53.03 45.89 27.86 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.389 0.614 . . . . 0.0 111.112 177.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.666 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -84.73 161.19 20.11 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.351 -177.305 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.588 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 30.8 t-20 -126.08 -177.68 4.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.875 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -100.03 -152.77 26.9 Favored Glycine 0 C--O 1.225 -0.444 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.009 -176.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.818 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -70.35 146.37 50.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.979 0.419 . . . . 0.0 110.864 179.938 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.4 m -59.23 98.04 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.516 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.39 4.89 65.79 Favored Glycine 0 C--O 1.229 -0.203 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.424 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.818 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 1.6 t-20 -128.93 100.56 5.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.181 0.515 . . . . 0.0 110.796 -177.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.19 71.85 9.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.282 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -166.21 -61.71 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.981 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.71 113.44 18.9 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.023 0.439 . . . . 0.0 110.973 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.826 ' H ' HG21 ' A' ' 41' ' ' THR . . . -107.53 153.71 22.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.216 173.508 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.604 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 0.1 OUTLIER -126.53 141.04 52.0 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.538 -175.5 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.922 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -105.41 128.6 53.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.333 0.587 . . . . 0.0 110.043 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.65 ' HG2' ' HB2' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -76.83 170.17 16.96 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.724 -176.808 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.482 ' HB2' HD22 ' A' ' 12' ' ' LEU . . . -60.55 -27.74 67.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.879 0.371 . . . . 0.0 111.308 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.55 -31.11 63.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.945 0.879 . . . . 0.0 109.071 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.65 ' HB2' ' HG2' ' A' ' 69' ' ' LYS . 0.5 OUTLIER -80.96 -27.07 36.16 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.277 178.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 69' ' ' LYS . 23.8 mm -64.6 -42.77 96.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.724 176.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -20.57 63.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.385 177.065 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.474 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -70.38 -53.83 14.96 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.504 -177.075 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.422 HD13 ' HG ' ' A' ' 50' ' ' LEU . 0.7 OUTLIER -136.95 -5.92 1.89 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -171.894 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.44 51.92 7.01 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 119.799 -1.191 . . . . 0.0 112.12 -178.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.408 ' O ' HG23 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -62.36 83.68 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.968 0.413 . . . . 0.0 111.781 -176.962 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.416 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -71.91 4.85 3.01 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -175.191 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.63 -23.13 42.82 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -175.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.922 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -125.57 -4.47 7.16 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.22 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.509 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -115.94 138.22 47.09 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.525 0 CA-C-O 121.513 0.673 . . . . 0.0 111.789 -177.382 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.859 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 21.7 t70 -112.96 153.44 28.02 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.962 -1.017 . . . . 0.0 108.578 176.114 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -117.65 103.33 9.93 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.998 -174.24 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 78.3 p -104.75 -168.69 1.51 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.396 175.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.401 ' HG2' ' H ' ' A' ' 86' ' ' GLU . 0.4 OUTLIER -66.03 -25.32 67.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.771 0.32 . . . . 0.0 111.043 179.521 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.771 ' HB3' ' HB3' ' A' ' 16' ' ' ALA . 2.5 mp0 -71.54 -32.01 67.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.286 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 130.2 -146.1 17.2 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.481 -0.866 . . . . 0.0 111.794 -178.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -74.76 108.7 2.76 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.958 2.439 . . . . 0.0 111.346 175.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.497 HG12 ' HB2' ' A' ' 18' ' ' PHE . 0.6 OUTLIER -122.41 162.51 22.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.05 -179.231 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -67.27 124.17 22.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.941 0.401 . . . . 0.0 110.52 -177.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.859 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 2.4 tttp -70.83 -24.0 62.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.827 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.444 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -152.8 -95.18 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.14 -174.343 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.444 HG13 ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -92.81 136.77 23.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.597 -173.024 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -97.61 129.23 48.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 172.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -140.8 163.8 31.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.921 0.391 . . . . 0.0 111.363 -174.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.84 109.08 19.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.159 177.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.771 ' O ' ' HA ' ' A' ' 31' ' ' SER . 64.1 m -110.87 116.79 51.51 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.505 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.0 132.9 14.56 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.273 1.982 . . . . 0.0 111.934 177.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.12 120.18 23.28 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.086 176.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.5 ' O ' ' HB ' ' A' ' 102' ' ' THR . . . 137.87 -52.01 0.76 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.077 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.5 ' HB ' ' O ' ' A' ' 101' ' ' GLY . 5.1 t 176.33 177.52 0.24 Allowed 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.506 -0.183 . . . . 0.0 110.506 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 76.34 157.75 0.19 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.023 0.929 . . . . 0.0 112.517 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.588 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.3 OUTLIER -75.08 175.52 8.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.818 -175.023 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 10.9 m -112.11 141.9 45.22 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.884 -178.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.7 m -91.88 138.94 18.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.616 174.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.7 128.93 44.73 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -94.61 7.03 6.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.591 0.71 . . . . 0.0 110.781 -178.042 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.6 t70 . . . . . 0 C--N 1.315 -0.933 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.38 172.558 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.459 HD22 ' HA ' ' A' ' 12' ' ' LEU . 1.0 OUTLIER . . . . . 0 CA--C 1.53 0.209 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.98 -41.37 64.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.161 0.505 . . . . 0.0 110.5 -178.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.21 6.39 8.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.901 -178.29 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.519 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 15.2 m -72.92 -25.78 61.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.14 174.168 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.94 -53.51 0.51 Allowed 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.906 0.754 . . . . 0.0 111.354 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.542 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . . . -63.1 -33.01 74.54 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.858 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.605 ' HE2' ' SG ' ' A' ' 34' ' ' CYS . 15.9 t80 -72.14 -28.46 63.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.151 177.271 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.33 -22.32 63.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.748 177.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.542 ' HE2' ' HA ' ' A' ' 17' ' ' ALA . 55.4 mttm -67.63 -29.58 68.94 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.146 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.82 -31.91 73.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.639 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.13 -18.63 63.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.526 -177.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -108.66 -25.1 11.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.783 179.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -77.13 -26.43 61.97 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.319 179.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.769 HG21 HG21 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -137.99 155.44 48.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.666 0.269 . . . . 0.0 110.433 -179.649 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.16 95.73 9.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.198 0.523 . . . . 0.0 110.414 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -148.44 132.25 17.01 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.642 175.908 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -80.38 173.71 12.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.318 -177.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.8 p -55.78 -41.76 67.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 120.751 0.31 . . . . 0.0 111.356 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -95.36 12.36 68.02 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.295 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.576 ' HA ' ' HA ' ' A' ' 99' ' ' PRO . 0.7 OUTLIER -130.68 16.35 5.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.949 0.404 . . . . 0.0 110.637 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -106.49 133.14 51.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 175.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.509 ' CB ' ' HB3' ' A' ' 98' ' ' CYS . . . -150.45 178.97 8.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.503 0.668 . . . . 0.0 112.319 -171.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.605 ' SG ' ' HE2' ' A' ' 18' ' ' PHE . 3.8 m -127.45 135.07 49.9 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.792 -1.095 . . . . 0.0 108.806 171.044 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.551 ' HB3' ' HB ' ' A' ' 94' ' ' ILE . 0.4 OUTLIER -110.92 158.41 18.77 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.111 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.643 ' OD1' ' HB3' ' A' ' 40' ' ' GLU . 11.0 t-20 -148.96 159.24 44.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.679 0.276 . . . . 0.0 110.843 -172.312 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.465 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -50.61 132.71 27.13 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.528 177.489 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 37' ' ' SER . 63.8 Cg_exo -53.38 -43.3 58.63 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.31 2.673 . . . . 0.0 113.42 -177.514 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.09 -8.12 52.82 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.969 0.414 . . . . 0.0 111.029 -177.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.643 ' HB3' ' OD1' ' A' ' 36' ' ' ASN . 1.5 tt0 -103.47 -46.81 4.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.563 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 43.8 m -60.18 -38.12 82.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.978 176.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.403 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -102.41 14.74 31.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.006 -177.541 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -62.4 -42.02 99.11 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.144 -177.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 1.046 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 21.7 t70 -87.57 140.88 29.07 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.531 178.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.26 -40.24 89.62 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.825 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.62 -19.73 22.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.046 -175.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 1.046 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -57.24 -35.64 69.96 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.209 -179.729 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.42 -23.32 67.35 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.87 0.366 . . . . 0.0 111.386 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -100.7 -19.07 18.83 Favored Glycine 0 C--N 1.33 0.229 0 N-CA-C 111.283 -0.727 . . . . 0.0 111.283 174.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.606 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 2.3 tp -64.34 -35.06 79.65 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 122.596 0.359 . . . . 0.0 110.904 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.57 ' HB2' HD22 ' A' ' 56' ' ' LEU . 0.2 OUTLIER -72.43 -34.55 67.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.172 0.511 . . . . 0.0 110.637 178.972 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.21 53.37 4.76 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.568 -175.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.79 -27.48 61.16 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.4 0.619 . . . . 0.0 110.527 178.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -137.9 -94.28 0.33 Allowed Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.519 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.58 ' HB3' ' HA2' ' A' ' 101' ' ' GLY . 0.5 OUTLIER -130.23 58.82 1.65 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.94 0.4 . . . . 0.0 110.027 178.448 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.57 HD22 ' HB2' ' A' ' 51' ' ' LEU . 0.5 OUTLIER -80.81 103.1 10.43 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.59 0.71 . . . . 0.0 110.146 177.885 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.436 ' ND2' ' H ' ' A' ' 57' ' ' ASN . 1.3 p30 -89.99 171.4 9.6 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 114.47 -1.241 . . . . 0.0 109.375 175.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.31 -160.12 34.3 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.581 -0.819 . . . . 0.0 113.168 -174.416 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.479 ' HA ' HD23 ' A' ' 59' ' ' LEU . 0.8 OUTLIER -67.98 159.33 30.88 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 122.545 0.338 . . . . 0.0 111.671 -178.303 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.586 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 0.4 OUTLIER -55.04 87.23 0.01 OUTLIER 'General case' 0 C--O 1.233 0.187 0 C-N-CA 123.841 0.856 . . . . 0.0 111.918 178.909 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.77 8.05 84.99 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.514 178.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -120.5 102.38 8.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.976 0.417 . . . . 0.0 111.509 -178.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.37 104.17 5.82 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.51 176.029 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 157.37 -61.38 0.33 Allowed Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.178 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.85 119.88 21.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.902 0.382 . . . . 0.0 110.073 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -114.27 135.83 53.64 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.197 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.07 132.36 56.68 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.882 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -103.78 129.32 51.18 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.055 0.455 . . . . 0.0 110.305 -177.199 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.474 ' HG3' ' HG2' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -75.63 168.03 20.79 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.323 -177.023 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.87 -31.88 67.13 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.678 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.6 -35.44 73.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.261 0.553 . . . . 0.0 109.541 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.696 HD12 HD11 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -76.89 -32.49 57.47 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.294 178.849 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.1 mt -60.81 -38.3 78.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.579 176.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.54 -24.47 49.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.033 177.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.408 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -77.04 -53.67 7.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.26 -0.427 . . . . 0.0 112.077 -175.406 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.606 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.9 OUTLIER -117.41 -24.43 7.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -172.9 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.89 50.59 6.85 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 119.974 -1.108 . . . . 0.0 112.367 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.696 HD11 HD12 ' A' ' 72' ' ' LEU . 2.4 mp -74.86 92.85 2.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.946 0.403 . . . . 0.0 110.735 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -77.46 6.51 6.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.713 -177.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.87 -44.86 79.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.236 0.541 . . . . 0.0 110.379 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.882 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -94.74 2.83 55.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.231 -176.808 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 16.3 t -115.22 138.29 46.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.234 0.54 . . . . 0.0 110.826 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.658 ' HB2' ' HD3' ' A' ' 92' ' ' LYS . 31.7 t0 -128.97 164.69 22.62 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 175.102 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -110.23 135.81 50.41 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.081 0.467 . . . . 0.0 111.513 -176.652 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.1 p -120.92 -169.51 1.84 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.343 176.268 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -66.93 -32.49 73.78 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.745 0.653 . . . . 0.0 109.941 174.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.519 ' HB3' ' O ' ' A' ' 15' ' ' SER . 0.5 OUTLIER -72.93 -54.81 7.72 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.873 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 166.43 -152.13 20.93 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.253 -0.975 . . . . 0.0 112.403 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -70.09 120.75 7.43 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 123.001 2.467 . . . . 0.0 111.022 174.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.4 -175.16 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.948 0.404 . . . . 0.0 111.064 -174.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.51 125.27 26.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.791 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.658 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 14.3 tptm -68.89 -41.46 78.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.82 -177.194 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -146.68 -63.36 0.3 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.575 -172.298 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.551 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 2.2 mt -109.19 122.15 63.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.99 0.424 . . . . 0.0 111.718 -173.042 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -85.46 126.92 40.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.806 175.527 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -154.29 152.58 30.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.303 -176.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 6.9 m -104.17 107.87 18.97 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 176.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.509 ' HB3' ' CB ' ' A' ' 33' ' ' ALA . 53.9 t -119.66 117.25 32.79 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.571 -173.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.66 ' HG2' HG21 ' A' ' 102' ' ' THR . 3.1 Cg_exo -80.01 154.8 22.76 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.047 2.498 . . . . 0.0 111.944 175.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.474 ' HG2' ' HG3' ' A' ' 69' ' ' LYS . 0.9 OUTLIER -88.27 100.89 13.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 171.885 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.58 ' HA2' ' HB3' ' A' ' 55' ' ' LEU . . . 110.73 68.42 0.57 Allowed Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.217 -0.992 . . . . 0.0 112.53 -178.12 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.66 HG21 ' HG2' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -146.28 -177.8 5.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.746 0.308 . . . . 0.0 111.081 -178.406 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 14.1 m -82.23 -47.88 11.92 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 172.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.586 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 18.0 p30 -154.63 163.69 39.86 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.138 174.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.509 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 34.7 m -112.34 141.99 45.4 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -97.25 132.21 42.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.184 0.516 . . . . 0.0 111.499 -172.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.45 130.97 35.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.503 173.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.769 HG21 HG21 ' A' ' 25' ' ' THR . 0.0 OUTLIER -108.98 25.13 2.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.938 -172.424 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 . . . . . 0 C--N 1.324 -0.531 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.501 179.498 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.497 ' C ' ' H ' ' A' ' 14' ' ' THR . 6.3 mp . . . . . 0 CA--C 1.527 0.096 0 CA-C-O 120.523 0.201 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 69.26 -32.28 0.22 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.968 0.907 . . . . 0.0 111.774 -178.357 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.497 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -156.51 -57.42 0.09 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 47.6 46.78 17.86 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.189 -178.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.09 -62.02 2.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.943 0.401 . . . . 0.0 111.441 -173.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.11 -25.47 55.45 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.958 0.408 . . . . 0.0 110.76 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -64.66 -38.26 90.41 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.419 178.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.92 -19.92 64.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.492 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.88 -30.08 63.68 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.397 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.6 -26.16 61.59 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.289 176.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.0 -5.55 44.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.79 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -81.01 -21.36 40.27 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.151 0.501 . . . . 0.0 110.18 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.78 -27.71 49.51 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.703 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.415 ' OG1' HG11 ' A' ' 108' ' ' VAL . 0.3 OUTLIER -141.39 113.17 7.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.865 0.364 . . . . 0.0 110.942 -179.674 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.9 m -68.66 113.38 6.1 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.925 175.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.469 ' HB3' HG13 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -148.6 161.77 41.03 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.698 178.414 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.443 ' H ' ' HB2' ' A' ' 31' ' ' SER . 17.0 t-20 -87.44 171.49 10.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.777 -176.472 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.8 m -63.86 -36.81 77.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.831 0.348 . . . . 0.0 110.599 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -92.39 25.29 18.7 Favored Glycine 0 N--CA 1.451 -0.326 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 175.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.494 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 1.4 m -142.79 -9.19 0.81 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.069 0.462 . . . . 0.0 110.523 177.289 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.469 HG13 ' HB3' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -94.81 133.79 34.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 177.596 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.639 ' HB2' ' HG3' ' A' ' 69' ' ' LYS . . . -148.59 165.54 30.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.459 0.647 . . . . 0.0 112.625 -171.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.4 t -124.5 144.51 50.06 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.798 -1.092 . . . . 0.0 109.309 173.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.584 ' HB3' HG12 ' A' ' 94' ' ' ILE . 0.1 OUTLIER -124.41 155.53 38.67 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.771 0.319 . . . . 0.0 110.402 -179.311 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.424 HD22 ' HB2' ' A' ' 40' ' ' GLU . 1.6 t30 -134.59 159.49 41.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.737 178.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.38 142.9 67.58 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.789 178.652 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.415 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 74.2 Cg_exo -51.49 -33.04 45.73 Favored 'Trans proline' 0 N--CA 1.478 0.567 0 C-N-CA 123.797 2.998 . . . . 0.0 113.847 -174.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.83 -7.65 23.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.023 0.439 . . . . 0.0 111.56 -178.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.424 ' HB2' HD22 ' A' ' 36' ' ' ASN . 1.1 mt-10 -113.38 -39.98 3.98 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.202 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.19 -33.32 75.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.44 0.638 . . . . 0.0 110.61 176.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 2.2 m-80 -102.92 14.05 32.87 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.274 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -66.34 -28.95 69.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.614 -176.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.94 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 7.3 t0 -115.06 140.86 48.71 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.871 177.166 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -26.3 66.0 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.991 0.424 . . . . 0.0 110.745 177.486 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.466 ' HA ' HD13 ' A' ' 46' ' ' LEU . 1.0 OUTLIER -86.0 -24.0 26.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.175 177.756 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.94 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -62.12 -42.63 99.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.249 -177.436 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.591 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -65.38 -26.97 68.23 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.708 -175.562 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.84 -21.35 33.9 Favored Glycine 0 C--N 1.329 0.151 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.349 174.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.753 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 1.2 tp -70.72 -35.82 72.9 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.473 -0.363 . . . . 0.0 110.564 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.591 HD21 ' HA ' ' A' ' 48' ' ' SER . 1.6 pp -74.15 -26.13 60.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.241 -178.458 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.95 58.01 2.88 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.696 -177.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.701 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -79.55 59.61 3.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.075 0.464 . . . . 0.0 111.575 -176.492 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 120.22 70.14 0.31 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.615 176.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 15.0 mt 56.59 32.55 21.14 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.351 0.596 . . . . 0.0 111.363 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.88 145.0 31.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.099 -177.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.686 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 4.6 t-20 -120.68 -178.24 3.67 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.416 ' HA3' ' HA ' ' A' ' 66' ' ' ALA . . . -116.3 -122.7 3.44 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.521 -0.847 . . . . 0.0 112.245 -175.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.963 HD23 ' HB2' ' A' ' 65' ' ' SER . 1.8 mm? -65.31 144.09 57.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.683 0.277 . . . . 0.0 110.726 -179.276 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.58 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -58.17 94.16 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.813 -179.793 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.42 -8.02 79.51 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 121.125 -0.56 . . . . 0.0 113.237 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -105.57 141.46 36.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.446 0.641 . . . . 0.0 111.583 -175.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -104.37 136.37 44.08 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.78 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 112.74 -39.29 2.91 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.886 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.963 ' HB2' HD23 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -97.46 116.22 29.25 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.592 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.453 ' HB1' HD13 ' A' ' 51' ' ' LEU . . . -128.32 150.81 49.91 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.491 -178.577 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -129.97 146.72 51.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.673 0.273 . . . . 0.0 110.932 -177.019 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.516 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -114.83 155.21 27.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.156 178.083 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.639 ' HG3' ' HB2' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -100.44 174.85 5.91 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.814 -173.545 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.452 ' O ' ' HB ' ' A' ' 73' ' ' ILE . . . -61.3 -39.34 90.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.111 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.5 -36.42 83.79 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.979 0.418 . . . . 0.0 110.488 177.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.701 HD11 ' HB3' ' A' ' 53' ' ' ALA . 1.2 tp -72.88 -21.85 60.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.844 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.452 ' HB ' ' O ' ' A' ' 70' ' ' ALA . 0.2 OUTLIER -60.43 -40.22 83.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.874 176.369 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -88.27 2.17 52.96 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.317 0.58 . . . . 0.0 110.736 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.66 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 3.5 tp60 -94.23 -53.66 3.86 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.062 -177.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.753 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.8 OUTLIER -121.02 -16.05 8.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 -174.246 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.77 49.09 45.0 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.326 -0.94 . . . . 0.0 112.075 -179.048 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.44 ' H ' HD12 ' A' ' 78' ' ' LEU . 0.7 OUTLIER -76.72 98.47 4.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.905 0.383 . . . . 0.0 111.272 -176.194 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 3.82 11.3 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.406 179.259 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.46 -41.11 80.67 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -177.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.516 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -116.83 4.0 12.94 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -174.097 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.4 t -111.18 136.71 46.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.292 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.717 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 5.5 t0 -119.33 168.19 11.17 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -129.97 99.1 4.97 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.936 0.398 . . . . 0.0 111.189 -177.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 41.4 p -96.88 -169.09 1.81 Allowed 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 173.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -81.87 8.22 10.88 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.313 0.578 . . . . 0.0 110.081 175.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -104.74 4.29 32.24 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.645 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 99.69 -161.24 19.55 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.139 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -65.2 116.9 4.12 Favored 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.853 2.369 . . . . 0.0 111.237 173.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.5 m -134.19 177.78 6.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.04 0.448 . . . . 0.0 111.717 -172.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.7 130.89 44.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.473 177.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.717 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttm -82.38 -32.89 28.96 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.884 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -141.8 -94.55 0.13 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.768 -174.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.584 HG12 ' HB3' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -107.0 147.73 11.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.015 0.436 . . . . 0.0 111.217 -172.748 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.439 HG13 HG12 ' A' ' 108' ' ' VAL . 3.3 p -100.66 139.55 21.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.431 -179.221 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.49 160.67 41.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.001 0.429 . . . . 0.0 111.694 -175.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 1.3 m -104.89 107.73 18.86 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 174.578 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.689 ' HA ' ' HB3' ' A' ' 105' ' ' CYS . 9.9 t -124.62 108.47 28.79 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.901 -169.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.532 ' HD2' ' SG ' ' A' ' 105' ' ' CYS . 56.9 Cg_endo -69.47 126.71 13.83 Favored 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 122.633 2.222 . . . . 0.0 112.568 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.17 104.43 6.69 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 164.11 -67.46 0.22 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.399 -0.905 . . . . 0.0 112.687 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -161.59 159.13 27.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.751 0.276 . . . . 0.0 111.353 -177.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.563 HG22 ' H ' ' A' ' 104' ' ' ASN . 1.3 m 72.53 166.95 0.31 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.584 0.707 . . . . 0.0 112.699 171.263 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.686 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 11.5 p30 -74.46 163.5 27.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.312 -172.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.689 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 9.3 m -120.34 144.59 47.78 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.941 -175.538 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -90.66 148.31 4.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.482 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.52 140.39 43.36 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.497 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.439 HG12 HG13 ' A' ' 95' ' ' VAL . 0.8 OUTLIER -100.98 -0.26 10.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.512 0.672 . . . . 0.0 111.051 -178.341 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ASP . . . . . 0.414 ' OD2' ' HB ' ' A' ' 94' ' ' ILE . 1.9 t70 . . . . . 0 C--N 1.317 -0.809 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.284 176.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.53 0.2 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.14 -32.18 38.95 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.631 -177.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.73 5.11 4.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.863 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 87' ' ' GLU . 94.5 p -80.97 -34.33 33.2 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.279 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.09 -53.22 0.47 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.914 0.886 . . . . 0.0 111.27 -175.273 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.66 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . . . -66.82 -24.55 66.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.77 -177.384 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.631 ' HB2' HG12 ' A' ' 90' ' ' VAL . 36.3 t80 -87.9 -25.99 22.96 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.17 174.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.43 -40.21 93.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.272 178.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.66 ' HD3' ' HA ' ' A' ' 17' ' ' ALA . 0.0 OUTLIER -69.54 -24.51 63.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.462 0.649 . . . . 0.0 109.815 176.599 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -74.63 -34.01 62.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.05 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.68 ' HB1' HD11 ' A' ' 32' ' ' ILE . . . -67.78 -18.51 64.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.758 -177.325 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -87.05 -1.14 57.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.984 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -73.98 -26.37 69.09 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.069 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.56 172.32 13.06 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.99 96.9 1.36 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.986 0.422 . . . . 0.0 109.936 173.174 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 66.7 m -130.49 134.59 47.2 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.85 -175.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -145.45 -163.08 1.64 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.463 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 p -61.96 135.23 26.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.996 0.427 . . . . 0.0 110.121 177.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.93 -8.19 4.82 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 120.964 -0.636 . . . . 0.0 113.226 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -114.1 -6.35 13.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.952 0.405 . . . . 0.0 110.698 179.936 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.68 HD11 ' HB1' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -91.68 128.79 43.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.84 177.2 10.03 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.063 0.458 . . . . 0.0 111.707 -174.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.3 m -140.54 147.47 39.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.625 173.035 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -128.33 160.27 32.71 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.238 0.542 . . . . 0.0 111.039 -176.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 42.6 t-20 -153.78 159.98 42.09 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.129 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -48.58 137.88 12.13 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 123.636 0.585 . . . . 0.0 111.452 177.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.589 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 10.0 Cg_endo -52.91 -35.21 69.88 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.281 2.654 . . . . 0.0 112.94 -179.398 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.44 -19.88 62.47 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.82 0.343 . . . . 0.0 111.735 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -91.92 -52.45 4.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.136 0.493 . . . . 0.0 110.018 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.552 ' O ' ' HB3' ' A' ' 47' ' ' LEU . 1.2 t -69.99 -21.05 63.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.643 -177.411 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.589 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.3 m120 -105.94 7.46 32.1 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.478 -179.043 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -66.8 -34.49 77.93 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.323 0.582 . . . . 0.0 110.704 -178.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 1.099 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 13.3 t0 -96.37 134.68 39.22 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.216 177.479 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.19 -24.82 68.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.815 0.341 . . . . 0.0 111.244 -179.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.2 tp -91.76 -22.08 20.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.935 0.398 . . . . 0.0 110.831 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 1.099 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -66.08 -31.68 72.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.007 -177.144 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.593 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -67.94 -14.52 63.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.243 -179.052 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -104.82 -20.03 10.37 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.598 173.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.463 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 1.1 mp -73.35 -22.37 60.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.889 0.376 . . . . 0.0 111.185 -177.053 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.593 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.3 OUTLIER -75.63 -12.55 60.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.327 -178.737 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.434 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -138.27 86.53 0.22 Allowed Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.561 -178.629 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.59 ' HB2' HD21 ' A' ' 72' ' ' LEU . . . -65.37 -21.69 66.71 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -177.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.59 67.12 0.37 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.353 -0.927 . . . . 0.0 113.044 179.373 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 mp 61.49 40.89 13.28 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.157 0.503 . . . . 0.0 111.74 173.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.451 HD11 ' H ' ' A' ' 101' ' ' GLY . 0.1 OUTLIER -72.86 172.45 10.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.414 -178.371 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -117.03 -177.83 3.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.86 -176.08 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -116.34 -151.49 9.65 Favored Glycine 0 C--O 1.228 -0.271 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.209 -175.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.415 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -66.43 134.75 53.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.839 0.352 . . . . 0.0 110.308 177.958 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.48 105.78 1.01 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.798 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 102.15 -38.7 3.06 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.453 176.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -95.98 102.87 14.72 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.666 0.27 . . . . 0.0 110.653 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.15 71.38 2.89 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.015 0.436 . . . . 0.0 111.103 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -160.83 -58.76 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.012 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.18 139.62 44.57 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.877 0.37 . . . . 0.0 111.158 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.31 131.68 48.65 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 m -115.71 131.69 56.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.103 0.477 . . . . 0.0 110.688 -176.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -104.37 144.0 32.24 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.849 -177.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.731 ' HG3' ' HG2' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -89.82 161.26 16.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.49 -174.088 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.595 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -58.38 -25.64 62.28 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -175.448 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.86 -27.15 60.14 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.808 0.813 . . . . 0.0 109.005 -177.647 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.59 HD21 ' HB2' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -90.93 -17.12 26.94 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.306 -178.461 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.616 HG12 HG21 ' A' ' 82' ' ' VAL . 1.3 mt -66.15 -39.42 84.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.3 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.22 7.91 20.32 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.126 0.489 . . . . 0.0 110.731 177.341 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.504 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.8 OUTLIER -88.27 -53.41 4.71 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.763 -179.31 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.2 0.83 2.88 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -173.238 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.78 52.98 4.16 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 119.718 -1.229 . . . . 0.0 113.055 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.492 ' O ' HG23 ' A' ' 82' ' ' VAL . 4.5 mm? -67.97 66.56 0.1 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 122.663 0.385 . . . . 0.0 111.849 -178.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.34 -4.87 28.49 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -175.598 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.48 -31.23 42.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.76 0.314 . . . . 0.0 111.623 -176.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.0 mt -102.81 -21.95 13.96 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.955 0.407 . . . . 0.0 111.177 -174.587 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.616 HG21 HG12 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -110.28 138.17 39.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.196 178.971 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.695 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 16.5 t0 -110.78 158.66 18.42 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.748 176.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -116.28 116.33 27.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.257 0.551 . . . . 0.0 111.575 -177.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.5 p -107.94 -175.47 2.79 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.397 -0.82 . . . . 0.0 108.873 174.033 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -66.12 -27.74 68.28 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.805 0.336 . . . . 0.0 111.448 -177.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 15' ' ' SER . 1.1 pm0 -70.65 -39.59 73.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.032 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 151.62 -159.79 28.45 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.108 -178.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -71.57 122.31 8.48 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 123.056 2.504 . . . . 0.0 111.286 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.631 HG12 ' HB2' ' A' ' 18' ' ' PHE . 1.5 m -138.51 169.83 17.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.76 -175.303 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.56 127.21 31.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.724 0.297 . . . . 0.0 110.481 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.695 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 2.0 tttt -67.36 -64.45 0.85 Allowed 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.082 -173.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.48 -61.8 1.37 Allowed 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.512 -172.259 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.9 mt -108.83 119.24 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.107 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.4 p -79.85 112.05 17.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.416 0.627 . . . . 0.0 109.831 175.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -151.02 137.69 18.83 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.068 -176.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 1.2 m -104.66 149.87 25.19 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.975 0.417 . . . . 0.0 110.482 -176.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 31' ' ' SER . 7.2 t -148.08 136.35 11.25 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.079 -167.456 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -81.95 152.19 16.62 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.701 2.267 . . . . 0.0 111.927 178.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.731 ' HG2' ' HG3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -89.43 157.24 18.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.864 0.364 . . . . 0.0 110.094 175.532 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.451 ' H ' HD11 ' A' ' 56' ' ' LEU . . . 96.87 -56.31 1.32 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.068 -0.587 . . . . 0.0 111.99 -178.16 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.7 t -177.97 -173.77 0.4 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.7 m 74.75 148.66 0.1 Allowed 'General case' 0 C--N 1.33 -0.251 0 O-C-N 123.849 0.718 . . . . 0.0 111.195 -177.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -74.29 174.6 8.59 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.467 -175.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.98 146.82 34.61 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.894 177.502 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -102.05 138.44 26.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.853 0.359 . . . . 0.0 110.356 -177.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -110.48 108.32 18.28 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 4.9 p -74.88 -4.15 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.735 0.779 . . . . 0.0 111.622 -173.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.311 -1.105 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.41 179.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.505 ' HG ' HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.83 -30.83 71.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.923 0.392 . . . . 0.0 111.239 -179.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.31 -17.15 56.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.407 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.15 74.43 6.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.43 179.129 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.65 -40.14 62.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.549 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.58 -31.0 71.04 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.893 -177.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.559 ' HB2' HG12 ' A' ' 90' ' ' VAL . 88.8 t80 -70.18 -43.95 69.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.118 0.485 . . . . 0.0 110.111 -179.003 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.22 -30.24 48.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.366 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -63.3 -35.46 80.43 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.664 0.745 . . . . 0.0 109.237 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -30.43 67.17 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.526 176.223 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.56 -8.54 56.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.649 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.89 -5.62 59.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.031 0.443 . . . . 0.0 110.273 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.24 -9.16 55.93 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.156 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.5 m -134.57 152.78 52.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.82 95.58 7.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.14 0.495 . . . . 0.0 111.655 -177.779 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.497 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -140.95 155.91 46.16 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 173.206 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -112.85 -179.32 3.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.533 0.206 . . . . 0.0 110.481 -174.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.1 m -60.38 138.07 21.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 176.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 80.11 -13.84 24.12 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.321 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.693 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -104.93 -2.94 23.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.79 0.295 . . . . 0.0 111.228 179.556 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.418 ' H ' HG12 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -81.26 106.12 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 176.9 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.658 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -122.25 144.92 48.68 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.991 0.424 . . . . 0.0 111.649 -173.252 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 5.5 t -107.98 133.37 52.4 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.519 174.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.716 ' HB2' ' HB ' ' A' ' 94' ' ' ILE . 37.5 m -112.68 149.66 32.58 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.51 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.496 ' HB2' HD23 ' A' ' 81' ' ' LEU . 38.1 t-20 -136.56 152.8 50.89 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 174.5 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m -45.8 133.8 6.6 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 123.485 0.49 . . . . 0.0 110.884 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.4 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 6.3 Cg_endo -47.02 -44.92 22.25 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 124.043 3.162 . . . . 0.0 114.351 -172.585 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.1 -11.24 60.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.952 0.406 . . . . 0.0 111.835 -176.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.92 -38.66 6.91 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.558 HG23 HD13 ' A' ' 47' ' ' LEU . 1.4 m -60.26 -43.12 96.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.21 173.793 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.4 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 2.9 m-20 -90.01 5.88 44.68 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.192 -176.564 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -81.19 -7.61 59.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.427 0.632 . . . . 0.0 109.646 175.165 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -96.34 144.16 26.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.349 177.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -82.32 -21.68 35.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.329 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.545 ' HB3' HD11 ' A' ' 78' ' ' LEU . 3.2 mp -82.06 -52.86 6.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.619 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.784 ' HA ' ' HB3' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -54.05 -36.62 63.28 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.935 179.994 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 t -58.75 -25.23 62.79 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.401 -178.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -105.72 -24.06 7.19 Favored Glycine 0 C--N 1.334 0.422 0 N-CA-C 111.534 -0.627 . . . . 0.0 111.534 173.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.784 ' HB3' ' HA ' ' A' ' 47' ' ' LEU . 0.4 OUTLIER -67.87 -20.06 65.09 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 122.75 0.42 . . . . 0.0 110.783 179.189 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.484 ' HG ' ' CB ' ' A' ' 66' ' ' ALA . 0.0 OUTLIER -46.08 -35.23 4.73 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.652 0.595 . . . . 0.0 111.736 177.489 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.8 79.34 0.32 Allowed Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.485 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.414 ' CB ' HD11 ' A' ' 72' ' ' LEU . . . -67.53 -28.34 67.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.556 0.693 . . . . 0.0 109.251 174.63 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -133.96 -107.55 0.99 Allowed Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 110.361 -1.096 . . . . 0.0 110.361 172.349 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.1 mt -117.68 47.13 1.6 Allowed 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 174.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.408 HD11 ' OE2' ' A' ' 100' ' ' GLU . 2.2 mt -78.0 176.17 9.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.877 -174.157 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.579 ' CB ' ' HA ' ' A' ' 104' ' ' ASN . 3.0 m120 -138.83 -177.43 4.87 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.737 -175.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -112.41 -135.86 6.59 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.671 -0.775 . . . . 0.0 112.089 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.657 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -64.88 150.23 48.11 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.855 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.458 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -55.06 89.07 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.094 0.557 . . . . 0.0 112.099 -179.78 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.92 2.29 61.14 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 121.079 -0.582 . . . . 0.0 112.443 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.657 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 32.5 t-20 -122.35 98.22 5.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.944 0.402 . . . . 0.0 110.345 -179.003 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.16 72.7 9.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.237 0.542 . . . . 0.0 111.134 178.172 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.72 -48.17 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 -179.654 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -81.23 113.47 19.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 174.626 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.484 ' CB ' ' HG ' ' A' ' 51' ' ' LEU . . . -105.78 156.05 18.69 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.835 0.35 . . . . 0.0 111.011 -176.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.4 m -134.42 141.73 46.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.041 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.636 ' HB2' HD21 ' A' ' 50' ' ' LEU . . . -108.06 126.01 52.24 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.935 0.398 . . . . 0.0 110.454 176.776 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.658 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -80.77 166.42 21.0 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.694 175.758 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -50.72 -38.42 47.18 Favored 'General case' 0 C--N 1.329 -0.297 0 O-C-N 123.433 0.458 . . . . 0.0 111.813 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.3 -37.31 80.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.592 179.385 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.781 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -82.77 -23.24 34.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.71 -178.292 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.505 HG21 ' HG ' ' A' ' 12' ' ' LEU . 2.4 mt -63.88 -40.26 88.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 173.559 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -83.74 -4.34 58.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.118 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.781 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.3 OUTLIER -81.7 -53.46 6.2 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 120.972 0.415 . . . . 0.0 110.58 -179.245 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.557 HD22 ' HB2' ' A' ' 50' ' ' LEU . 6.7 mp -110.98 -21.92 11.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.015 -176.131 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.41 46.09 6.64 Favored Glycine 0 CA--C 1.511 -0.186 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.275 -176.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.727 HD13 HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -76.79 147.18 37.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -174.036 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.84 14.9 5.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.328 174.331 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.1 -25.65 43.01 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.023 0.44 . . . . 0.0 111.09 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.496 HD23 ' HB2' ' A' ' 36' ' ' ASN . 8.1 mt -109.68 4.13 21.66 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.704 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -116.71 138.24 47.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.353 0.597 . . . . 0.0 110.819 -176.391 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.625 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 6.8 t0 -119.62 144.12 47.3 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 175.68 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -103.94 112.15 25.0 Favored 'General case' 0 C--N 1.316 -0.854 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.067 -174.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.0 p -107.46 -169.36 1.52 Allowed 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.963 174.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.8 pm0 -61.62 -24.44 66.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.604 178.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.35 -34.41 31.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.727 0.299 . . . . 0.0 111.092 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 143.48 -160.03 27.6 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.115 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_exo -71.92 97.55 0.83 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.207 2.604 . . . . 0.0 111.463 175.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.559 HG12 ' HB2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -113.01 -174.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.899 -175.722 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.456 ' SG ' HG12 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -67.69 127.66 33.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.084 0.469 . . . . 0.0 110.832 -177.793 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.625 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 6.5 tptp -73.53 -36.73 65.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.622 -178.571 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -144.37 -78.53 0.2 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -170.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.844 HG23 ' HB3' ' A' ' 109' ' ' ASP . 4.6 mt -110.92 136.18 47.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.404 -170.666 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.456 HG12 ' SG ' ' A' ' 91' ' ' CYS . 13.2 m -101.76 139.65 22.36 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 120.738 0.304 . . . . 0.0 110.853 177.405 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -155.24 166.92 32.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.134 0.492 . . . . 0.0 111.81 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.497 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.8 m -113.2 117.71 32.65 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 173.468 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.693 ' O ' ' HA ' ' A' ' 31' ' ' SER . 39.8 t -123.6 124.46 26.21 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.504 -175.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -84.26 127.9 4.06 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.815 2.343 . . . . 0.0 113.028 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.408 ' OE2' HD11 ' A' ' 56' ' ' LEU . 0.7 OUTLIER -73.33 105.37 4.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.042 0.448 . . . . 0.0 110.519 175.074 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 169.54 -80.44 0.1 OUTLIER Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 176.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.51 161.32 32.74 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 122.728 0.411 . . . . 0.0 109.892 176.724 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 23.7 m 79.76 150.66 0.11 Allowed 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.779 0.674 . . . . 0.0 110.733 -179.519 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.579 ' HA ' ' CB ' ' A' ' 57' ' ' ASN . 0.3 OUTLIER -71.28 173.9 7.15 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -168.679 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.575 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.15 142.83 44.13 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.496 -177.624 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -99.16 127.91 51.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 121.061 0.458 . . . . 0.0 110.031 -177.29 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -94.48 136.01 35.27 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.818 177.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.71 -0.99 9.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.275 0.559 . . . . 0.0 111.271 -178.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ASP . . . . . 0.844 ' HB3' HG23 ' A' ' 94' ' ' ILE . 17.7 t0 . . . . . 0 C--N 1.318 -0.786 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.283 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.525 ' C ' ' H ' ' A' ' 14' ' ' THR . 7.9 mp . . . . . 0 N--CA 1.457 -0.108 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 70.68 -24.98 0.16 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.808 0.843 . . . . 0.0 111.393 -178.017 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.525 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -170.57 -42.57 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.508 ' HG ' ' N ' ' A' ' 12' ' ' LEU . 25.3 m 64.69 -74.45 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.416 -177.49 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.519 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . 52.99 -91.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.052 0.541 . . . . 0.0 111.307 -177.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.836 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . . . -63.15 -32.18 73.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.804 0.335 . . . . 0.0 110.526 177.065 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.523 ' HE2' ' SG ' ' A' ' 34' ' ' CYS . 28.5 t80 -68.71 -32.66 72.61 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.158 0.504 . . . . 0.0 110.05 176.676 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.34 -37.04 80.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.587 177.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.836 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 23.1 mttt -64.9 -36.96 86.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.38 0.609 . . . . 0.0 109.403 174.616 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -59.99 -40.87 90.63 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.309 174.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.21 -16.64 61.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.467 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.56 -40.44 11.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.658 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -75.83 -27.88 61.91 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.757 -177.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -114.33 146.23 40.78 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.586 0.231 . . . . 0.0 110.393 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.55 92.93 9.07 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 121.398 0.618 . . . . 0.0 111.208 -178.461 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.537 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -160.3 131.23 5.64 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 170.469 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -111.36 -175.15 2.63 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.517 -174.167 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.7 t -58.34 117.07 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.174 0.511 . . . . 0.0 109.849 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.538 ' O ' ' HA ' ' A' ' 99' ' ' PRO . . . 113.82 -23.68 12.87 Favored Glycine 0 N--CA 1.441 -1.001 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 -174.644 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.96 4.4 5.35 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.81 0.338 . . . . 0.0 111.2 178.325 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.448 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 5.3 tt -96.79 129.52 46.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.887 0.375 . . . . 0.0 110.807 -177.695 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.75 172.81 15.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.223 0.535 . . . . 0.0 111.929 -176.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.523 ' SG ' ' HE2' ' A' ' 18' ' ' PHE . 55.9 m -124.54 142.09 51.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.741 170.485 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -117.2 145.02 44.15 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.536 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.725 ' HB2' ' HB3' ' A' ' 81' ' ' LEU . 13.2 t-20 -131.6 159.74 37.37 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.942 0.401 . . . . 0.0 111.031 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -54.5 142.06 52.33 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.612 175.617 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.555 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 11.5 Cg_endo -55.39 -38.54 93.8 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 123.107 2.538 . . . . 0.0 112.795 -175.688 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.37 -16.69 64.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.963 0.411 . . . . 0.0 111.937 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -102.81 -42.68 5.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.526 179.58 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.66 -25.81 65.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.054 0.454 . . . . 0.0 110.841 178.757 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.555 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.3 m120 -104.84 14.29 29.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.4 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -62.32 -26.01 68.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.013 -175.735 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 1.026 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 14.6 t70 -122.03 150.85 41.51 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.588 0.232 . . . . 0.0 110.394 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.98 -35.03 79.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.216 -179.037 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.32 -15.99 26.64 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.464 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 1.026 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 5.0 tp -60.98 -40.94 95.35 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.085 -178.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -29.84 69.91 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.12 -177.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -84.59 -29.84 28.66 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.726 -0.749 . . . . 0.0 111.754 177.104 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.481 ' HA ' HD12 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -68.53 -20.81 64.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.919 0.39 . . . . 0.0 110.972 179.275 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.617 HD12 ' HB2' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -56.57 -30.99 63.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.236 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.608 ' HA3' ' HB2' ' A' ' 56' ' ' LEU . . . -137.24 100.07 0.31 Allowed Glycine 0 N--CA 1.441 -1.031 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.033 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.492 ' H ' HD21 ' A' ' 72' ' ' LEU . . . -75.1 55.14 0.72 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.107 0.479 . . . . 0.0 110.481 177.217 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 164.61 -118.08 0.79 Allowed Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.556 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.5 mp -120.02 52.89 1.1 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.933 0.397 . . . . 0.0 110.199 -177.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.608 ' HB2' ' HA3' ' A' ' 52' ' ' GLY . 0.3 OUTLIER -88.36 166.9 13.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.269 0.557 . . . . 0.0 111.828 -175.816 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.436 ' HB3' ' O ' ' A' ' 103' ' ' THR . 45.7 t30 -132.83 -179.13 5.29 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.384 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -101.64 -153.56 25.74 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.502 -0.856 . . . . 0.0 112.684 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.875 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 9.5 tp -67.38 143.47 56.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.561 0.22 . . . . 0.0 110.842 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.1 m -59.34 94.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.524 -179.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.62 -13.86 63.67 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.6 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.875 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 6.7 t-20 -99.72 92.22 5.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.021 0.439 . . . . 0.0 110.934 -177.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -76.14 72.22 2.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.049 176.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -179.46 -48.13 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.34 130.84 37.14 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.702 0.287 . . . . 0.0 110.397 176.733 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.02 164.58 14.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.204 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 0.2 OUTLIER -129.36 127.96 42.11 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 120.822 0.344 . . . . 0.0 110.169 -178.46 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 1.016 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -109.43 148.82 30.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.983 178.07 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' A' ' 32' ' ' ILE . 1.5 mppt? -92.46 168.25 11.4 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.614 -175.53 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.665 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -61.15 -32.62 72.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.197 -179.108 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.11 -48.6 77.84 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 176.173 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.514 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -57.78 -40.45 79.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.786 177.172 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.934 ' HA ' ' HB2' ' A' ' 78' ' ' LEU . 11.4 mt -60.73 -47.82 91.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.63 179.554 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.95 -30.64 70.83 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.1 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.437 ' C ' ' HG ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -62.58 -53.82 48.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.538 -171.231 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.437 ' HG ' ' C ' ' A' ' 75' ' ' GLN . 0.5 OUTLIER -138.67 25.53 2.59 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -171.247 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.508 ' O ' ' HG ' ' A' ' 79' ' ' LEU . . . 67.27 51.24 39.34 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 119.774 -1.203 . . . . 0.0 111.5 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.934 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 0.1 OUTLIER -73.53 72.57 1.4 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -174.227 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.798 ' HA ' ' HB ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -87.85 20.93 2.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.84 0.352 . . . . 0.0 110.905 178.092 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.432 ' HB2' ' HG ' ' A' ' 47' ' ' LEU . . . -65.1 -27.56 68.84 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.265 0.555 . . . . 0.0 110.558 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 1.016 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -132.52 13.09 4.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.123 179.502 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.798 ' HB ' ' HA ' ' A' ' 79' ' ' LEU . 53.8 t -115.36 137.3 49.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.615 -173.175 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -118.99 148.95 42.43 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 175.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 30.7 t-80 -109.87 115.49 29.91 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.089 -0.645 . . . . 0.0 111.65 -176.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.494 ' HB ' ' OE2' ' A' ' 87' ' ' GLU . 6.4 p -108.29 -173.92 2.39 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.466 174.518 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.47 -27.19 65.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.058 0.456 . . . . 0.0 110.051 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 16' ' ' ALA . 1.9 mp0 -68.33 -24.39 64.82 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.015 176.649 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 129.47 -158.54 22.17 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.418 178.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -73.79 120.21 6.29 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 123.188 2.592 . . . . 0.0 111.53 176.298 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.481 HG12 ' HB2' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -137.56 166.86 23.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.282 -175.878 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 9.0 m -67.09 139.02 57.54 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.217 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.9 tttp -75.93 -49.85 16.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.643 -175.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -129.9 -86.0 0.53 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -170.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 5.6 mt -85.52 132.73 31.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.036 -168.483 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -94.5 123.79 46.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.386 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.428 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . . . -153.33 151.73 30.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.527 -178.577 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.537 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 3.7 m -105.45 123.59 48.14 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.281 0.562 . . . . 0.0 109.699 178.253 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 26.6 t -130.31 128.57 22.71 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.983 -172.439 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.538 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 10.5 Cg_exo -70.91 141.41 40.51 Favored 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.786 2.324 . . . . 0.0 112.275 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -88.2 103.99 16.29 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 171.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.437 ' H ' HD11 ' A' ' 56' ' ' LEU . . . 165.09 -78.65 0.13 Allowed Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.41 HG22 ' H ' ' A' ' 103' ' ' THR . 0.3 OUTLIER -155.33 -174.81 5.13 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.54 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.436 ' O ' ' HB3' ' A' ' 57' ' ' ASN . 23.8 p 62.99 178.22 0.15 Allowed 'General case' 0 C--O 1.235 0.302 0 O-C-N 124.177 0.923 . . . . 0.0 112.449 178.398 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -93.02 173.96 7.47 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.721 -168.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.442 ' O ' HD12 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -112.72 143.01 44.67 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.446 -176.308 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -87.46 141.82 13.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.917 0.389 . . . . 0.0 110.46 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.682 ' HB2' HD11 ' A' ' 59' ' ' LEU . . . -105.18 124.34 49.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.97 0.414 . . . . 0.0 110.902 -178.531 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -101.39 18.71 3.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.504 0.669 . . . . 0.0 109.828 178.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 48.0 t0 . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.208 178.461 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.8 mp . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.403 ' O ' ' HB ' ' A' ' 14' ' ' THR . . . 54.04 67.09 1.06 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.607 -176.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.403 ' HB ' ' O ' ' A' ' 13' ' ' ALA . 37.4 m 79.28 -37.74 0.19 Allowed 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.245 -178.564 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.618 ' HB3' ' HB3' ' A' ' 18' ' ' PHE . 0.9 OUTLIER 54.41 53.11 11.29 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.855 0.36 . . . . 0.0 111.689 174.748 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.409 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . -58.16 -58.08 10.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.209 -177.558 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.634 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . . . -73.84 -16.96 61.12 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.249 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.618 ' HB3' ' HB3' ' A' ' 15' ' ' SER . 80.3 t80 -79.51 -35.75 39.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.863 0.364 . . . . 0.0 110.474 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.88 -30.43 71.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.862 0.363 . . . . 0.0 110.796 176.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.634 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 46.4 mttt -69.29 -20.47 63.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.399 0.618 . . . . 0.0 109.711 176.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.92 -46.12 10.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.401 177.521 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.79 -18.43 64.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.892 -171.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.1 -21.0 60.83 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.669 -177.453 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -101.36 3.5 54.36 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.39 -0.91 . . . . 0.0 112.75 -178.371 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.438 HG22 ' HB ' ' A' ' 108' ' ' VAL . 0.0 OUTLIER -121.99 134.25 54.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.933 0.366 . . . . 0.0 111.815 -175.381 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.48 96.97 4.84 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.178 174.597 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.588 ' SG ' ' HA ' ' A' ' 32' ' ' ILE . 0.5 OUTLIER -150.67 172.61 15.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.507 -179.289 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -123.85 159.39 29.71 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.739 -0.21 . . . . 0.0 110.589 -173.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 p -65.72 120.05 11.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.451 0.643 . . . . 0.0 110.144 178.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.84 -38.89 2.92 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.453 -175.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.8 OUTLIER -90.98 -1.62 57.8 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.032 0.444 . . . . 0.0 110.925 178.743 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.588 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 2.0 tt -80.25 134.47 27.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.406 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.644 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . . . -144.14 173.03 12.09 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.877 0.846 . . . . 0.0 113.115 -167.617 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 28.4 t -122.4 133.49 54.63 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.295 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.3 t -117.47 157.58 26.0 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.742 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.464 ' HB2' ' CD2' ' A' ' 81' ' ' LEU . 8.7 t-20 -149.07 159.33 44.33 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.743 -175.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.402 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.3 OUTLIER -53.82 135.62 55.98 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.641 174.676 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.454 ' HG3' ' OG ' ' A' ' 65' ' ' SER . 74.5 Cg_exo -47.29 -46.76 18.94 Favored 'Trans proline' 0 C--O 1.22 -0.388 0 C-N-CA 123.576 2.851 . . . . 0.0 113.834 -172.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.451 ' HA ' ' OD1' ' A' ' 42' ' ' ASN . . . -60.93 -9.41 4.17 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -173.628 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.593 ' O ' ' HB2' ' A' ' 43' ' ' ASN . 4.6 tt0 -112.49 -41.36 3.88 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.5 m -59.28 -42.89 92.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.957 0.884 . . . . 0.0 110.584 171.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.451 ' OD1' ' HA ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -87.8 11.06 16.45 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.885 -175.243 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.593 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 1.8 t-20 -51.55 -34.8 38.13 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.968 -174.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 1.053 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 28.5 t70 -116.13 147.38 41.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.872 0.368 . . . . 0.0 110.997 178.337 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -40.52 97.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.134 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.28 -29.05 26.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.752 0.311 . . . . 0.0 110.319 -178.748 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 1.053 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -55.12 -32.94 62.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.574 173.346 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.508 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -65.84 -9.8 32.23 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.443 179.547 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -116.52 -8.89 11.99 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 172.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.595 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 1.2 tp -84.06 -19.99 33.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.976 0.417 . . . . 0.0 110.964 -176.073 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.508 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.1 OUTLIER -67.24 -21.61 65.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.415 -179.091 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.13 91.77 0.28 Allowed Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.52 ' H ' HD21 ' A' ' 72' ' ' LEU . . . -58.49 -30.75 67.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.767 0.318 . . . . 0.0 111.757 -174.316 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -96.14 29.73 9.65 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.694 -179.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.0 mt 61.59 54.95 2.88 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.4 0.619 . . . . 0.0 109.8 -175.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.608 HD22 ' NZ ' ' A' ' 69' ' ' LYS . 0.5 OUTLIER -80.89 -161.97 0.44 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.229 -176.498 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.436 ' H ' ' CG ' ' A' ' 56' ' ' LEU . 7.9 t-20 -133.03 -177.17 4.39 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.234 -174.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -95.52 -144.2 16.24 Favored Glycine 0 C--N 1.314 -0.645 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -176.174 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.801 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -66.59 155.03 38.94 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 175.074 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.524 ' HA ' ' ND2' ' A' ' 104' ' ' ASN . 1.6 t -61.33 100.49 0.13 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.013 0.435 . . . . 0.0 111.322 -178.077 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.01 -0.4 69.25 Favored Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.142 -179.019 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.801 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 24.1 t-20 -128.95 97.04 4.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.109 0.481 . . . . 0.0 110.257 -176.152 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.06 71.09 10.26 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.334 0.588 . . . . 0.0 111.072 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -167.23 -50.92 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.134 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.454 ' OG ' ' HG3' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -89.75 79.87 6.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.139 0.495 . . . . 0.0 109.862 174.312 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.463 ' HB3' HD22 ' A' ' 51' ' ' LEU . . . -86.7 164.19 16.9 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.199 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.789 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -131.86 153.03 50.62 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.578 -179.028 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -116.67 138.74 51.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.244 -178.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.793 ' HE3' HD23 ' A' ' 72' ' ' LEU . 0.0 OUTLIER -88.28 165.45 15.01 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.962 -177.083 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.436 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -62.33 -25.31 67.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.108 0.48 . . . . 0.0 110.96 -179.257 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -32.39 70.24 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.441 0.639 . . . . 0.0 109.577 177.763 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.793 HD23 ' HE3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -73.9 -30.82 62.8 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.574 178.992 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.436 HD12 ' HA ' ' A' ' 70' ' ' ALA . 3.5 mt -67.87 -35.68 73.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.597 176.271 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -74.8 -31.43 61.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.933 177.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.08 -52.83 6.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.824 -176.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.535 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 2.8 mm? -105.64 -45.81 4.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.443 -173.636 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.54 49.59 5.1 Favored Glycine 0 CA--C 1.518 0.279 0 C-N-CA 119.994 -1.098 . . . . 0.0 112.533 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.468 ' HB3' HD11 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -77.59 106.68 9.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.893 0.378 . . . . 0.0 110.978 -179.239 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.621 ' HA ' HG12 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -66.87 -18.29 65.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.938 -177.909 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.73 -21.65 64.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.809 0.337 . . . . 0.0 111.357 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.464 ' CD2' ' HB2' ' A' ' 36' ' ' ASN . 1.9 mt -123.45 28.6 6.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.291 0.567 . . . . 0.0 111.298 -176.743 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.621 HG12 ' HA ' ' A' ' 79' ' ' LEU . 2.0 p -142.44 145.41 23.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.313 176.407 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.604 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 9.8 t70 -122.88 171.09 9.47 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.05 177.456 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.31 80.29 1.79 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.143 0.497 . . . . 0.0 111.223 -174.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.541 HG23 ' H ' ' A' ' 87' ' ' GLU . 1.6 t -78.86 171.81 14.65 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 172.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -51.4 -38.98 56.23 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -176.126 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.541 ' H ' HG23 ' A' ' 85' ' ' THR . 17.1 mt-10 -88.91 48.35 1.62 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.0 0.429 . . . . 0.0 111.886 -176.119 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.44 -175.78 49.56 Favored Glycine 0 CA--C 1.522 0.482 0 CA-C-N 115.82 -0.627 . . . . 0.0 113.993 172.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -62.96 138.09 66.14 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.985 2.456 . . . . 0.0 111.547 175.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.453 HG11 ' HB3' ' A' ' 17' ' ' ALA . 0.3 OUTLIER -149.51 173.43 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.152 -172.815 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 14.1 t -67.64 143.3 56.07 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 174.019 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.604 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 2.8 tttp -78.24 -46.3 20.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.38 -176.344 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.514 ' HB3' HG13 ' A' ' 94' ' ' ILE . 4.5 m-20 -142.89 -82.14 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.029 0.442 . . . . 0.0 111.948 -172.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.514 HG13 ' HB3' ' A' ' 93' ' ' ASN . 2.1 mt -96.65 130.31 45.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.237 -170.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.3 p -83.42 138.06 19.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.668 0.27 . . . . 0.0 110.371 176.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.41 ' HA ' HG23 ' A' ' 108' ' ' VAL . . . -148.68 164.18 35.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.017 0.437 . . . . 0.0 111.926 -175.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.55 122.28 46.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.314 175.542 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.789 ' SG ' ' HB2' ' A' ' 67' ' ' CYS . 57.0 m -132.71 127.58 20.49 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.516 -173.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -86.89 178.11 3.8 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.118 1.879 . . . . 0.0 110.965 173.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.458 ' HA ' HD13 ' A' ' 56' ' ' LEU . 1.0 OUTLIER -123.94 157.52 34.12 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 168.99 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 102.26 -45.15 1.4 Allowed Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.865 -178.584 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.42 HG23 ' OG1' ' A' ' 103' ' ' THR . 10.5 t -177.92 174.97 1.36 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.824 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.6 OUTLIER 68.52 -175.11 0.2 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.594 176.672 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.824 ' H ' HG22 ' A' ' 103' ' ' THR . 10.9 p30 -104.91 -178.9 3.79 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.079 -164.016 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 68.6 m -112.52 143.48 43.6 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.858 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 86.9 t -103.71 113.33 40.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.176 175.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.98 118.32 18.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 174.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.438 ' HB ' HG22 ' A' ' 25' ' ' THR . 0.1 OUTLIER -96.05 17.61 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.806 -170.575 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 43.0 t0 . . . . . 0 C--N 1.32 -0.682 0 CA-C-O 121.556 0.693 . . . . 0.0 110.191 174.267 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.598 ' N ' ' HG ' ' A' ' 15' ' ' SER . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.263 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 74.76 -44.47 0.55 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.212 -172.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.437 ' O ' ' HB2' ' A' ' 15' ' ' SER . 0.5 OUTLIER -158.44 -40.16 0.06 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.79 -177.961 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.598 ' HG ' ' N ' ' A' ' 12' ' ' LEU . 2.7 m 69.75 -69.32 0.17 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.513 -177.299 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 47.26 -92.58 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.475 0.71 . . . . 0.0 112.154 178.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.521 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . . . -62.9 -30.53 71.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.191 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.63 ' HB2' HG12 ' A' ' 90' ' ' VAL . 15.3 t80 -67.12 -27.6 67.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 110.305 177.41 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.87 -20.85 60.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.539 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.521 ' HD3' ' HA ' ' A' ' 17' ' ' ALA . 5.0 mtpp -71.83 -26.84 62.54 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.34 -36.57 19.16 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 113.893 -1.503 . . . . 0.0 110.541 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.67 -14.0 61.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.055 -174.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -109.15 16.77 22.25 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.445 0.641 . . . . 0.0 110.442 175.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -115.86 -27.67 2.92 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.22 174.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.67 142.22 34.71 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -91.12 96.7 10.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.932 0.396 . . . . 0.0 110.741 178.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.444 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 81.6 m -148.92 -179.04 6.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -98.73 159.87 14.66 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.425 ' H ' HG22 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -64.12 -49.48 81.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 120.798 0.332 . . . . 0.0 111.581 -178.113 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.21 -27.67 57.46 Favored Glycine 0 CA--C 1.509 -0.3 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.803 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -100.77 46.17 0.95 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.717 0.294 . . . . 0.0 111.218 -175.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.3 tt -112.32 138.84 39.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 174.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.405 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -146.54 155.32 42.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.536 0.684 . . . . 0.0 112.626 -171.434 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.6 m -109.88 133.23 53.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.637 174.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.41 ' HA ' HD22 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -123.13 165.13 17.36 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.6 -178.387 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.421 ' HB3' ' OG1' ' A' ' 41' ' ' THR . 3.2 t30 -149.29 161.16 42.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.71 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -49.02 127.36 14.73 Favored Pre-proline 0 C--O 1.237 0.398 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.572 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.465 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 31.4 Cg_exo -47.93 -47.45 18.93 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 123.815 3.01 . . . . 0.0 113.925 -178.145 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.51 -20.58 56.49 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -173.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -102.91 -48.57 4.03 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.033 0.444 . . . . 0.0 109.839 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.448 HG21 HD21 ' A' ' 81' ' ' LEU . 88.1 m -59.31 -35.95 74.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.564 177.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.4 m-80 -103.88 14.69 30.29 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.316 -173.592 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -69.08 -21.64 64.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.217 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.928 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.0 t70 -103.66 152.76 21.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.495 179.252 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.91 -29.41 44.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.743 0.306 . . . . 0.0 111.441 -177.405 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.469 ' HG ' HD13 ' A' ' 50' ' ' LEU . 9.6 tp -90.03 -36.98 14.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.698 0.285 . . . . 0.0 110.493 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.928 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.4 OUTLIER -50.47 -38.69 45.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.67 178.058 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.424 ' HA ' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -63.97 -28.18 69.64 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.573 -176.349 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -95.31 -25.1 14.66 Favored Glycine 0 C--N 1.33 0.207 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.626 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.557 ' HB3' HD21 ' A' ' 78' ' ' LEU . 1.2 tp -63.64 -32.89 74.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.969 0.414 . . . . 0.0 110.623 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 47' ' ' LEU . 7.6 mt -60.53 -39.89 89.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.631 177.411 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.694 ' HA2' ' HG ' ' A' ' 56' ' ' LEU . . . -87.08 67.6 3.34 Favored Glycine 0 N--CA 1.443 -0.865 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.654 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -68.5 -23.85 64.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.435 0.636 . . . . 0.0 110.437 -176.593 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -124.55 25.66 5.89 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.046 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 63.74 39.26 8.65 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.471 0.653 . . . . 0.0 109.86 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.694 ' HG ' ' HA2' ' A' ' 52' ' ' GLY . 0.7 OUTLIER -80.32 179.66 7.57 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.038 177.392 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.936 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 7.9 t-20 -118.75 -177.27 3.27 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.37 -175.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -97.93 -143.06 14.1 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.453 -176.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.553 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -65.54 148.89 50.97 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 178.957 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.569 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -57.24 90.28 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.64 -178.684 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.78 -10.34 70.54 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.86 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.553 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 57.9 t30 -117.55 105.93 12.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.284 0.564 . . . . 0.0 111.72 -174.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.44 131.5 42.65 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.359 178.852 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.48 -56.44 0.73 Allowed Glycine 0 CA--C 1.509 -0.325 0 C-N-CA 121.1 -0.571 . . . . 0.0 111.954 177.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.2 90.97 4.92 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.97 0.414 . . . . 0.0 110.42 178.008 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.02 160.74 16.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.079 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 64.7 m -126.55 130.84 51.34 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.061 0.457 . . . . 0.0 110.994 -178.136 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -105.49 125.83 51.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.578 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.452 ' NZ ' ' HA ' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -82.66 167.47 18.22 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.771 -178.555 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.46 ' HB2' HD22 ' A' ' 12' ' ' LEU . . . -60.55 -30.28 69.68 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.301 0.572 . . . . 0.0 109.997 175.475 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -23.12 63.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.511 176.757 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.823 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 1.3 tp -87.65 -24.03 24.05 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.501 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -60.29 -38.01 75.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.152 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -90.52 -5.11 56.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.408 0.623 . . . . 0.0 110.704 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.823 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -87.38 -54.16 4.44 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.138 -176.798 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.486 ' HA ' HD13 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -126.73 -9.91 6.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.509 -176.495 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 67.33 47.93 60.92 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.407 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.557 HD21 ' HB3' ' A' ' 50' ' ' LEU . 65.6 mt -71.19 129.91 40.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.653 0.263 . . . . 0.0 111.264 -178.522 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.63 4.16 19.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.093 177.09 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.49 -29.56 62.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.098 -174.165 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.448 HD21 HG21 ' A' ' 41' ' ' THR . 0.0 OUTLIER -128.89 4.92 5.4 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.973 0.416 . . . . 0.0 111.355 -174.666 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 6.2 t -111.11 137.66 42.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.885 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.904 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 6.9 t0 -115.47 154.61 28.99 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.7 m80 -125.87 114.6 18.76 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.316 0.579 . . . . 0.0 110.179 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.07 -169.96 1.56 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.143 -177.425 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -72.63 -19.75 61.39 Favored 'General case' 0 C--N 1.323 -0.57 0 O-C-N 123.335 0.397 . . . . 0.0 111.0 -178.717 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -89.14 -14.05 37.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.01 177.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 128.85 -152.79 19.47 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.516 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -79.51 129.59 8.49 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 123.321 2.68 . . . . 0.0 111.91 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.63 HG12 ' HB2' ' A' ' 18' ' ' PHE . 3.1 m -149.55 -178.56 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.237 -175.811 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.92 133.7 43.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.237 177.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.904 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 8.1 tttp -74.98 -49.92 18.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.545 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -136.84 -74.91 0.42 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.149 -172.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.0 mt -98.93 138.63 22.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.602 -171.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.4 p -112.27 138.93 39.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.478 ' CB ' ' HA ' ' A' ' 107' ' ' ALA . . . -150.2 168.93 22.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.05 0.452 . . . . 0.0 111.867 -176.121 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.444 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -112.03 117.17 31.95 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 171.944 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.479 ' HA ' ' HB3' ' A' ' 105' ' ' CYS . 44.5 t -138.69 139.76 25.31 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.673 0.273 . . . . 0.0 111.735 -170.529 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -82.86 -178.42 3.88 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 123.35 2.7 . . . . 0.0 112.093 176.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.452 ' HA ' ' NZ ' ' A' ' 69' ' ' LYS . 3.2 tp10 -80.18 -30.63 38.82 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -177.676 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.594 ' HA2' ' HA ' ' A' ' 56' ' ' LEU . . . -178.82 64.56 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 119.532 -1.318 . . . . 0.0 113.202 -178.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -153.94 108.54 3.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.601 0.239 . . . . 0.0 110.471 175.084 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 54.61 -176.25 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.669 0.747 . . . . 0.0 112.52 -178.169 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.936 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -74.42 165.44 25.19 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.734 -178.009 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.479 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 2.5 m -111.03 143.16 42.16 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.002 -175.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.0 p -85.35 120.79 36.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.125 0.488 . . . . 0.0 111.254 -176.388 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.529 ' HB3' HD11 ' A' ' 59' ' ' LEU . . . -96.88 125.76 41.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.144 175.554 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -89.38 10.52 2.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.109 0.48 . . . . 0.0 110.945 -178.173 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.2 t0 . . . . . 0 C--N 1.322 -0.614 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.306 179.381 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.629 ' N ' ' HG ' ' A' ' 15' ' ' SER . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.139 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 70.88 -53.42 0.67 Allowed 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.59 0.756 . . . . 0.0 109.752 -167.607 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.61 -34.12 0.19 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.344 175.819 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.629 ' HG ' ' N ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER 62.53 32.34 16.57 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.398 -0.819 . . . . 0.0 112.096 175.467 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.1 -37.92 84.76 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.136 0.493 . . . . 0.0 110.073 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.37 -33.63 19.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.552 177.231 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.614 ' CD2' ' HG ' ' A' ' 12' ' ' LEU . 87.7 t80 -69.66 -44.35 70.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.453 -177.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.44 0.67 0.66 Allowed 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HG3' ' OE1' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -73.37 -5.89 42.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.623 0.725 . . . . 0.0 109.112 176.178 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.556 ' HB3' HD11 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -82.88 -8.82 59.54 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.377 176.97 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -109.11 3.76 22.29 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.757 175.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.47 ' OE1' ' HG3' ' A' ' 20' ' ' LYS . 41.6 mt-10 -115.68 -75.97 0.58 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.734 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -70.07 -42.52 67.62 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.893 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.472 ' OG1' ' HA ' ' A' ' 21' ' ' GLN . 0.2 OUTLIER -83.82 132.05 34.84 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.397 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.88 95.32 7.3 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.232 0.539 . . . . 0.0 110.681 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 60.7 m -144.56 -178.32 5.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.256 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -110.84 148.36 32.57 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.9 t -66.87 -47.43 82.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.912 0.387 . . . . 0.0 110.744 -177.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.73 18.51 5.81 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.322 177.475 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -152.42 38.0 0.54 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.107 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.556 HD11 ' HB3' ' A' ' 21' ' ' GLN . 0.2 OUTLIER -96.57 136.56 27.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.087 -178.964 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.477 ' HB2' ' HB3' ' A' ' 98' ' ' CYS . . . -149.53 -179.72 7.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.18 0.514 . . . . 0.0 112.204 -175.001 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.549 ' SG ' ' HE1' ' A' ' 18' ' ' PHE . 64.8 m -131.81 144.82 51.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.814 175.569 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.443 ' HA ' ' HG ' ' A' ' 81' ' ' LEU . 0.9 OUTLIER -134.72 165.08 26.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.645 0.26 . . . . 0.0 110.568 -176.105 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.461 ' CB ' HD12 ' A' ' 81' ' ' LEU . 33.7 t-20 -154.08 161.16 42.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.258 177.69 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.5 m -53.99 146.92 26.79 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.139 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.428 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 46.4 Cg_exo -56.58 -33.74 93.75 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 123.05 2.5 . . . . 0.0 113.004 -175.633 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.05 -14.87 63.32 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.61 -48.7 3.37 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.311 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.72 ' HA ' ' HB1' ' A' ' 80' ' ' ALA . 3.1 m -56.29 -36.28 68.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.468 178.518 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.8 m-80 -105.58 14.23 28.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.847 -174.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -62.53 -26.49 68.59 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.952 0.406 . . . . 0.0 111.178 -175.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.829 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 8.0 t70 -119.02 146.16 45.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.683 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -24.85 62.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.105 0.479 . . . . 0.0 111.122 -179.342 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.2 tp -90.83 -23.58 20.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.104 177.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.829 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.7 OUTLIER -60.01 -45.92 91.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.876 179.99 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.8 -32.87 74.64 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.931 -178.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -75.86 -22.3 74.78 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 121.011 -0.614 . . . . 0.0 111.778 176.282 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.574 ' HG ' ' HB3' ' A' ' 76' ' ' LEU . 0.7 OUTLIER -75.44 -26.17 58.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.038 0.447 . . . . 0.0 109.855 177.881 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.747 HD11 HD21 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -67.33 -40.33 85.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.716 179.139 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.66 72.19 1.72 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.336 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.37 -17.04 61.86 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.165 0.507 . . . . 0.0 110.312 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.24 47.46 0.8 Allowed Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.619 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.9 mt 55.39 51.79 12.38 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.181 0.515 . . . . 0.0 110.743 -177.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.726 HD21 ' H ' ' A' ' 101' ' ' GLY . 12.8 mt -88.84 172.27 9.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.887 -177.343 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.504 ' HB2' ' C ' ' A' ' 103' ' ' THR . 0.8 OUTLIER -114.59 -178.39 3.36 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.378 174.997 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -99.46 -131.88 7.49 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.346 -0.93 . . . . 0.0 111.025 178.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.827 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.3 OUTLIER -67.92 155.89 38.41 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 171.339 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.464 ' HA ' ' ND2' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -52.24 105.7 0.12 Allowed 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 120.84 0.352 . . . . 0.0 111.148 -178.128 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.14 33.26 85.27 Favored Glycine 0 C--N 1.335 0.506 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.414 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.827 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 25.1 t-20 -126.08 100.9 6.54 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.904 0.383 . . . . 0.0 110.399 -176.249 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.45 77.56 9.21 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.085 0.469 . . . . 0.0 111.105 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.07 -55.62 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.91 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.6 m -88.66 129.59 35.48 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 176.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.643 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . . . -131.82 153.96 49.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.592 0.234 . . . . 0.0 110.423 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.695 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 0.8 OUTLIER -118.09 135.55 54.13 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.272 0.558 . . . . 0.0 111.201 -174.343 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.406 ' CB ' HD23 ' A' ' 81' ' ' LEU . . . -105.71 146.52 29.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.294 177.719 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.517 ' HE3' ' HG2' ' A' ' 100' ' ' GLU . 1.6 mppt? -102.36 168.33 9.39 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.36 -36.14 77.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.019 0.437 . . . . 0.0 110.809 178.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.612 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -62.85 -27.7 69.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.517 176.861 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.572 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 4.0 mp -82.21 -25.55 34.1 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.709 -178.566 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.23 -36.68 77.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.045 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -100.05 4.08 44.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.767 177.039 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.612 ' HB2' ' O ' ' A' ' 71' ' ' SER . 1.0 OUTLIER -94.92 -53.89 3.67 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.114 -178.783 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.574 ' HB3' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -123.89 -30.98 3.46 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.964 -175.522 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.94 50.76 3.19 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.02 -1.086 . . . . 0.0 112.0 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.438 ' CD1' ' HB3' ' A' ' 50' ' ' LEU . 3.7 mm? -57.44 113.08 1.62 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.754 0.312 . . . . 0.0 110.976 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -97.27 6.32 48.57 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.189 -177.896 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.72 ' HB1' ' HA ' ' A' ' 41' ' ' THR . . . -89.37 -40.84 12.48 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -175.699 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.747 HD21 HD11 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -99.21 -4.68 31.47 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.728 -171.749 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 2.8 t -108.86 137.94 38.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.875 0.369 . . . . 0.0 111.023 -174.356 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.716 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 27.7 t0 -120.29 174.42 6.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.108 179.204 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 27.1 p80 -60.11 140.51 56.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.115 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.483 ' HB ' HG22 ' A' ' 90' ' ' VAL . 5.3 t -143.14 160.68 39.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.852 -177.112 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -115.29 16.18 16.85 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.436 0.636 . . . . 0.0 109.71 176.174 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.44 ' HB3' ' H ' ' A' ' 88' ' ' GLY . 6.4 tm-20 -139.8 -93.48 0.17 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.42 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.534 ' O ' HG13 ' A' ' 90' ' ' VAL . . . -122.62 160.35 17.1 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 175.127 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.511 ' O ' HD12 ' A' ' 12' ' ' LEU . 51.3 Cg_exo -52.21 128.84 28.8 Favored 'Trans proline' 0 N--CA 1.474 0.326 0 C-N-CA 122.791 2.328 . . . . 0.0 112.259 -176.419 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 88' ' ' GLY . 29.0 m -125.16 159.72 31.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.946 -175.234 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.4 m -66.84 142.52 57.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.066 0.46 . . . . 0.0 111.227 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.716 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 2.0 tttp -75.43 -37.92 60.1 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.692 -176.515 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 12.1 m-20 -146.63 -72.13 0.23 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.27 -0.423 . . . . 0.0 112.015 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.42 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 74.7 mt -86.87 126.68 40.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.566 -171.34 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 27.4 m -92.93 128.91 44.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.404 174.134 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.509 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . . . -154.84 156.68 36.64 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.796 0.331 . . . . 0.0 111.097 -176.206 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.58 131.27 53.18 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 174.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.51 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 28.3 t -143.73 134.86 12.54 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.154 -172.382 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -85.26 155.8 10.97 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 122.488 2.126 . . . . 0.0 111.838 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.517 ' HG2' ' HE3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -100.55 127.63 46.86 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 176.221 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.726 ' H ' HD21 ' A' ' 56' ' ' LEU . . . 100.41 -7.7 58.3 Favored Glycine 0 N--CA 1.44 -1.077 0 C-N-CA 120.745 -0.74 . . . . 0.0 113.379 176.449 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.76 121.15 10.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -172.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.504 ' C ' ' HB2' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 41.52 -135.11 0.28 Allowed 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.876 1.435 . . . . 0.0 114.876 168.708 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.469 ' H ' ' HB ' ' A' ' 103' ' ' THR . 9.3 p30 -111.83 179.57 3.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.558 0.694 . . . . 0.0 112.599 -164.237 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.695 ' SG ' ' HB2' ' A' ' 67' ' ' CYS . 0.0 OUTLIER -118.47 154.98 31.6 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.735 -1.12 . . . . 0.0 111.052 -176.727 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.3 m -103.76 137.92 30.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.348 178.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -104.57 142.04 35.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.087 -176.09 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -122.62 20.6 4.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.294 0.568 . . . . 0.0 111.21 -178.114 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 . . . . . 0 C--N 1.322 -0.613 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.86 -178.406 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.61 ' HG ' ' OG ' ' A' ' 15' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 121.017 0.436 . . . . 0.0 110.097 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.436 ' O ' ' HB ' ' A' ' 14' ' ' THR . . . 60.69 60.4 1.93 Allowed 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.551 177.636 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.436 ' HB ' ' O ' ' A' ' 13' ' ' ALA . 87.5 m 76.68 -48.9 0.56 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.412 -178.031 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.658 ' HB3' ' HB3' ' A' ' 18' ' ' PHE . 20.2 m 57.29 41.25 26.97 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.141 0.276 . . . . 0.0 111.108 179.167 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.574 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . -55.38 -50.14 70.49 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.771 0.319 . . . . 0.0 111.348 -173.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -93.61 -19.09 21.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.956 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.658 ' HB3' ' HB3' ' A' ' 15' ' ' SER . 19.9 t80 -70.13 -24.57 63.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.963 0.411 . . . . 0.0 110.089 177.721 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.96 -37.21 86.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.706 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.19 -33.4 71.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.519 0.676 . . . . 0.0 109.323 177.232 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.85 -39.05 80.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.475 176.645 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.43 -16.06 63.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.748 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -101.96 0.89 36.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.816 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.9 -32.43 63.65 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.913 -0.66 . . . . 0.0 111.94 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.04 158.89 44.07 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 177.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.52 95.3 1.78 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.214 0.531 . . . . 0.0 111.592 -176.514 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.1 m -148.24 150.36 33.55 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.123 176.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.44 -164.93 2.14 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 p -57.17 127.55 16.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.142 0.496 . . . . 0.0 110.5 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.537 ' O ' ' HA ' ' A' ' 99' ' ' PRO . . . 106.37 -30.46 9.53 Favored Glycine 0 N--CA 1.445 -0.743 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.177 -178.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.6 p -124.02 -11.17 7.61 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.6 tt -83.06 125.8 40.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.408 0.623 . . . . 0.0 110.751 -177.481 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.49 178.27 9.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.063 -179.476 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 12.2 m -125.8 137.84 53.8 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.221 173.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.493 ' C ' HD21 ' A' ' 81' ' ' LEU . 1.2 m -113.13 156.01 23.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.749 0.309 . . . . 0.0 110.824 -176.461 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.567 ' HB2' ' CD2' ' A' ' 81' ' ' LEU . 16.6 t-20 -141.52 159.39 42.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.959 0.409 . . . . 0.0 111.276 -177.021 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.78 138.52 95.37 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.998 175.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.557 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 11.9 Cg_endo -55.01 -34.61 87.61 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.006 2.471 . . . . 0.0 112.798 -175.076 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.8 -8.3 42.08 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.048 0.451 . . . . 0.0 111.61 -178.533 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -108.25 -50.28 3.06 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.446 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.849 HG22 HD21 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -61.57 -35.06 76.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.99 -1.004 . . . . 0.0 111.668 -179.658 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.557 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.7 m-80 -104.11 15.49 28.33 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.644 -172.02 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -58.91 -28.37 66.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.203 -177.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.935 ' HB3' ' HG ' ' A' ' 47' ' ' LEU . 15.0 t70 -122.52 146.16 47.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.191 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -22.33 62.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.815 -178.481 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.9 tp -90.38 -27.63 19.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.675 0.274 . . . . 0.0 110.299 178.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.935 ' HG ' ' HB3' ' A' ' 44' ' ' ASP . 19.2 mt -58.77 -40.6 84.4 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.643 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.87 -24.53 67.56 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.089 -178.056 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.55 -18.03 46.79 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.073 -0.584 . . . . 0.0 111.889 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.93 -18.14 48.13 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.166 0.508 . . . . 0.0 110.024 177.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.849 HD21 HG22 ' A' ' 41' ' ' THR . 0.1 OUTLIER -67.45 -43.19 81.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.696 176.847 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -104.16 86.85 0.53 Allowed Glycine 0 N--CA 1.442 -0.95 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.881 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.4 64.62 5.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.402 0.62 . . . . 0.0 109.559 174.397 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.36 -121.37 2.97 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 -175.172 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.659 ' HB3' HG23 ' A' ' 102' ' ' THR . 2.1 mt -111.92 47.59 1.04 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.069 0.462 . . . . 0.0 111.156 178.639 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.66 143.52 29.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.229 178.339 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -117.46 -177.56 3.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.711 -176.353 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -106.35 -142.42 10.84 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.599 -173.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.444 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -66.86 154.28 41.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.887 0.375 . . . . 0.0 111.14 -179.816 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.0 p -67.93 89.4 0.28 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.905 177.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.87 -45.07 1.47 Allowed Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 116.053 -0.522 . . . . 0.0 112.521 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.48 113.36 12.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.992 0.425 . . . . 0.0 111.064 -177.562 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.51 114.72 21.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.752 178.524 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 137.74 -53.08 0.73 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.754 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.53 136.58 44.08 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 176.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.513 ' HB3' HG21 ' A' ' 41' ' ' THR . . . -129.78 167.37 18.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.554 -178.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.463 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -125.43 130.14 51.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.188 178.5 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.407 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -105.34 136.23 45.27 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.795 0.331 . . . . 0.0 110.117 -178.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.457 ' HE2' ' HG3' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -100.99 155.73 17.81 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.094 -177.825 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.414 ' CB ' HD22 ' A' ' 12' ' ' LEU . . . -65.97 -23.61 66.63 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.122 -178.317 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -27.15 56.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.91 0.862 . . . . 0.0 109.17 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.6 -25.1 21.49 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.303 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.472 ' HA ' ' HB2' ' A' ' 78' ' ' LEU . 0.8 OUTLIER -63.2 -39.83 86.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.959 179.062 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -78.73 -2.99 42.01 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.17 0.51 . . . . 0.0 110.987 178.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.415 ' HB3' HD12 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -81.37 -39.16 25.45 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.724 -173.883 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.415 HD12 ' HB3' ' A' ' 75' ' ' GLN . 1.2 mp -143.84 14.81 1.73 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.707 -176.464 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.61 44.18 96.88 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.329 -0.939 . . . . 0.0 111.094 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.472 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 3.8 mp -53.47 126.41 21.36 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.183 -0.508 . . . . 0.0 111.143 -176.187 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.36 -1.8 11.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.772 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.702 ' HB2' HD22 ' A' ' 47' ' ' LEU . . . -79.78 -4.48 52.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.983 -174.617 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.567 ' CD2' ' HB2' ' A' ' 36' ' ' ASN . 0.3 OUTLIER -155.05 36.37 0.39 Allowed 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -172.955 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.15 137.96 37.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 120.999 0.428 . . . . 0.0 110.327 175.079 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.947 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 2.3 t0 -109.29 158.5 17.8 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 173.716 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -124.43 114.96 20.18 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 119.653 -0.819 . . . . 0.0 112.725 -170.628 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -107.95 -169.95 1.6 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.732 171.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -81.68 -7.62 59.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.72 0.295 . . . . 0.0 111.581 -175.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.574 ' HB3' ' HB3' ' A' ' 16' ' ' ALA . 0.3 OUTLIER -104.43 12.95 32.76 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 120.862 0.363 . . . . 0.0 110.782 -178.154 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 115.42 -166.43 12.22 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.602 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -80.07 136.05 11.41 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 123.369 2.713 . . . . 0.0 111.323 176.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -140.29 -170.76 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.289 -175.251 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -66.49 132.0 47.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.09 0.472 . . . . 0.0 110.802 -177.603 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.947 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 6.3 tptp -74.7 -35.29 62.74 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.408 -175.572 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -155.34 -74.34 0.11 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.603 -175.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.6 mp -98.89 138.11 24.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.39 -172.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 25.7 t -97.28 118.47 43.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.945 178.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -144.03 160.67 40.47 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.745 0.307 . . . . 0.0 110.99 -176.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.13 124.8 50.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.497 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 45.9 t -136.0 117.85 11.89 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.971 -172.199 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.537 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 89.2 Cg_endo -76.14 138.27 20.18 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 122.863 2.375 . . . . 0.0 112.058 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.457 ' HG3' ' HE2' ' A' ' 69' ' ' LYS . 3.8 tt0 -85.91 139.33 31.33 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.54 176.568 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 128.62 -63.41 0.62 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.976 -0.63 . . . . 0.0 111.55 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.659 HG23 ' HB3' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -167.28 176.18 6.88 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 122.635 0.374 . . . . 0.0 110.196 178.378 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.537 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.7 OUTLIER 73.84 166.11 0.29 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.672 0.749 . . . . 0.0 112.158 177.407 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.537 ' H ' HG22 ' A' ' 103' ' ' THR . 21.5 m-20 -79.01 173.18 12.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.644 -1.162 . . . . 0.0 112.224 -174.129 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.497 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -113.27 142.94 45.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.744 175.381 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -102.91 142.01 17.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.066 0.46 . . . . 0.0 111.215 -175.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -106.86 122.84 47.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.339 177.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.33 17.59 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.931 -177.141 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.834 -178.032 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.486 ' N ' ' HG ' ' A' ' 15' ' ' SER . 3.8 mp . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 120.584 0.231 . . . . 0.0 110.39 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 69.48 -13.63 0.37 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.716 0.806 . . . . 0.0 111.888 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.47 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -164.26 -55.3 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 177.705 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.508 ' HB2' ' H ' ' A' ' 16' ' ' ALA . 0.3 OUTLIER 56.7 -96.69 0.07 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.991 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.508 ' H ' ' HB2' ' A' ' 15' ' ' SER . . . 53.46 -91.97 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.66 0.6 . . . . 0.0 111.507 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.599 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . . . -53.85 -38.78 65.02 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.059 0.457 . . . . 0.0 110.871 174.468 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.512 ' HB2' HG12 ' A' ' 90' ' ' VAL . 65.5 t80 -73.5 -35.18 65.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.539 177.43 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 23' ' ' GLU . . . -65.16 -21.06 66.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.577 -174.459 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.599 ' HE3' ' HA ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -52.4 -24.43 7.73 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.943 0.401 . . . . 0.0 111.115 177.033 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.93 -31.49 72.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.918 179.088 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.46 -17.25 27.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.21 -176.336 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.506 ' HG3' ' HA ' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -97.26 -45.31 6.55 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.871 -179.26 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.57 -37.07 21.42 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.377 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.94 153.43 28.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.871 0.367 . . . . 0.0 111.025 -177.497 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.66 98.35 11.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.999 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.2 m -135.5 170.8 15.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.746 176.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.418 ' H ' ' HB2' ' A' ' 31' ' ' SER . 2.2 t-20 -111.16 164.83 12.45 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.053 -173.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -61.06 -35.52 65.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.243 -178.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -107.14 35.97 4.69 Favored Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 176.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.756 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 15.6 m -145.84 -9.29 0.54 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.409 -0.395 . . . . 0.0 111.263 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -81.18 126.11 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.034 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.12 -179.33 6.95 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.336 0.589 . . . . 0.0 112.061 -169.59 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.433 ' O ' HD13 ' A' ' 81' ' ' LEU . 7.8 t -136.86 141.07 42.78 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.124 172.508 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -122.61 151.66 41.23 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.082 -178.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -135.71 157.05 47.81 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.66 135.54 7.8 Favored Pre-proline 0 C--N 1.33 -0.252 0 O-C-N 124.05 0.843 . . . . 0.0 110.922 177.561 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -49.91 -38.68 48.78 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.589 2.859 . . . . 0.0 113.609 -174.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.45 -8.86 54.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.973 0.416 . . . . 0.0 111.663 -177.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -109.13 -35.37 6.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.143 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -42.22 81.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.611 0.72 . . . . 0.0 110.259 175.692 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -95.27 15.46 19.22 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.531 -178.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -58.72 -32.3 69.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.886 178.754 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.993 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 24.7 t70 -108.4 136.1 48.6 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.672 174.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -25.28 65.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.733 0.301 . . . . 0.0 111.573 -176.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.3 tp -91.78 -22.85 19.94 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.956 178.079 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.993 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.1 OUTLIER -55.92 -46.45 78.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.273 -178.362 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.568 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -61.8 -24.2 66.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.039 0.447 . . . . 0.0 111.358 -179.261 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -96.03 -5.89 59.37 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.579 -0.819 . . . . 0.0 111.74 177.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.806 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 1.3 tp -83.96 -33.52 24.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.826 0.346 . . . . 0.0 110.194 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.568 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.3 OUTLIER -73.86 -32.54 63.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.362 178.334 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.659 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -84.9 69.04 3.39 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.551 -0.833 . . . . 0.0 111.996 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.27 55.46 2.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.419 0.628 . . . . 0.0 109.812 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 141.27 -112.42 0.77 Allowed Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.611 -0.996 . . . . 0.0 110.611 -175.158 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.72 60.29 1.03 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.159 0.504 . . . . 0.0 110.215 175.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.659 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 0.2 OUTLIER -87.08 142.13 28.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.165 178.768 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.564 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 1.0 OUTLIER -111.59 -178.0 3.33 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.382 -176.742 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -109.84 -155.12 15.34 Favored Glycine 0 C--O 1.227 -0.305 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.148 -175.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.483 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -65.7 146.45 54.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.794 0.33 . . . . 0.0 110.64 176.838 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.9 m -66.09 93.15 0.19 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.778 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 109.83 -58.87 0.37 Allowed Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.868 -178.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -71.71 99.43 2.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.034 0.445 . . . . 0.0 110.615 -179.672 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.73 70.27 8.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.394 0.616 . . . . 0.0 110.586 179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -166.72 -54.47 0.03 OUTLIER Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.536 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.69 120.28 14.43 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 175.222 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.507 ' HB1' HD13 ' A' ' 51' ' ' LEU . . . -115.74 142.16 47.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.559 -178.436 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.497 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 1.0 OUTLIER -110.98 128.95 56.01 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.593 -178.407 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 1.036 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -111.63 140.5 46.2 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.013 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.719 ' HD2' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -94.69 174.65 7.0 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.32 -174.733 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.26 -31.36 71.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.104 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.474 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.9 OUTLIER -67.13 -36.31 81.62 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.702 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.527 HD13 ' HA ' ' A' ' 72' ' ' LEU . 0.1 OUTLIER -75.24 -36.16 61.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.494 178.788 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.8 mt -61.51 -41.73 91.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.295 0.569 . . . . 0.0 109.641 175.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -77.22 -7.36 55.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.001 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' A' ' 71' ' ' SER . 2.0 tp-100 -95.03 -54.35 3.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.873 -177.067 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.806 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -122.87 -6.4 8.49 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -173.148 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 65.79 49.74 57.46 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.546 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.4 mp -70.95 97.5 1.44 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.735 0.302 . . . . 0.0 111.516 -176.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.911 ' HA ' HG12 ' A' ' 82' ' ' VAL . 0.0 OUTLIER -86.86 18.51 3.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.932 0.396 . . . . 0.0 111.323 179.743 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.4 -26.36 35.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.895 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 1.036 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.1 OUTLIER -126.03 -4.34 6.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.647 -178.309 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.911 HG12 ' HA ' ' A' ' 79' ' ' LEU . 1.9 p -104.68 141.33 20.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.21 0.529 . . . . 0.0 110.704 -177.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -129.37 174.92 9.18 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.465 177.009 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -133.67 107.76 8.14 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.951 0.405 . . . . 0.0 111.049 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.498 ' C ' ' H ' ' A' ' 87' ' ' GLU . 17.5 p -79.97 -168.82 1.76 Allowed 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 173.854 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -75.9 28.02 0.11 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.165 0.507 . . . . 0.0 110.403 173.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.498 ' H ' ' C ' ' A' ' 85' ' ' THR . 1.4 mm-40 -126.39 -101.32 0.37 Allowed 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.501 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -135.58 -158.83 8.36 Favored Glycine 0 N--CA 1.445 -0.71 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 178.28 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -69.01 117.84 5.29 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.552 2.168 . . . . 0.0 111.12 176.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.512 HG12 ' HB2' ' A' ' 18' ' ' PHE . 2.5 m -129.14 170.89 17.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.174 0.511 . . . . 0.0 111.74 -173.62 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.4 t -67.82 118.86 11.62 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.167 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 35.7 tttp -69.27 -30.15 68.2 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.114 -178.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.417 ' HB3' ' H ' ' A' ' 94' ' ' ILE . 0.6 OUTLIER -152.29 -105.84 0.05 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.142 0.496 . . . . 0.0 111.989 -173.407 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.443 HG23 ' HB3' ' A' ' 109' ' ' ASP . 3.7 mt -76.61 126.6 37.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.781 -168.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -91.7 132.22 36.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 175.643 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.497 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . . . -152.87 158.91 42.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.969 -176.304 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -105.85 116.71 32.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.966 0.412 . . . . 0.0 110.01 179.646 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.756 ' O ' ' HA ' ' A' ' 31' ' ' SER . 5.6 t -129.5 117.31 18.64 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.083 -173.658 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -73.71 146.1 37.9 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 122.648 2.232 . . . . 0.0 112.748 -178.115 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.3 129.11 35.9 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 173.272 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 130.09 -60.89 0.67 Allowed Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.792 -0.718 . . . . 0.0 111.91 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -169.36 174.79 5.85 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 122.917 0.487 . . . . 0.0 109.949 176.275 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 17.2 m 79.42 144.86 0.08 Allowed 'General case' 0 N--CA 1.462 0.159 0 O-C-N 124.043 0.84 . . . . 0.0 111.942 176.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.564 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -70.67 176.02 4.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.491 -1.231 . . . . 0.0 111.185 -178.049 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.471 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -110.96 141.96 43.7 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.898 -176.151 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 3.3 m -88.07 145.75 7.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.289 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.92 121.45 45.27 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.891 0.377 . . . . 0.0 111.084 -177.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.28 30.52 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.564 177.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ASP . . . . . 0.443 ' HB3' HG23 ' A' ' 94' ' ' ILE . 34.3 p-10 . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.409 -175.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.469 0.512 0 CA-C-O 121.147 0.499 . . . . 0.0 110.834 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.14 -32.88 5.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.31 0.576 . . . . 0.0 110.221 178.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.29 -22.02 45.21 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.895 178.279 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.11 76.23 6.86 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.599 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.8 -28.36 65.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.315 0.579 . . . . 0.0 110.076 175.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.468 ' HB3' HG11 ' A' ' 90' ' ' VAL . . . -64.64 -33.44 75.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.397 177.032 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -72.67 -30.88 64.64 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.51 -38.28 86.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.939 174.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' A' ' 17' ' ' ALA . 1.4 mtpp -69.97 -36.88 75.55 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.688 0.756 . . . . 0.0 109.072 175.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.91 -25.24 68.06 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.787 176.396 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.459 ' HA ' HD11 ' A' ' 32' ' ' ILE . . . -68.61 -14.96 63.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.45 . . . . 0.0 112.019 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -110.6 9.4 23.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.096 0.474 . . . . 0.0 110.383 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.28 -12.5 73.15 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 175.062 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.3 m -151.83 139.97 20.24 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 176.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.73 97.29 1.06 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.639 0.257 . . . . 0.0 110.97 -179.109 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.8 m -149.21 165.59 31.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.123 -177.207 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.533 ' O ' ' HB ' ' A' ' 32' ' ' ILE . 21.2 m120 -115.83 174.7 5.89 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.624 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 t -55.6 -42.99 71.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -178.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.24 9.43 72.22 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.423 -0.894 . . . . 0.0 113.131 -176.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.498 ' OG ' ' HB2' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -131.57 2.71 4.15 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.139 0.495 . . . . 0.0 110.958 -179.82 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.533 ' HB ' ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -89.8 132.7 33.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.577 -179.484 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.705 ' HB2' ' HD2' ' A' ' 69' ' ' LYS . . . -145.07 156.16 43.75 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.485 0.659 . . . . 0.0 111.791 -175.67 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.3 t -108.64 130.85 55.32 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 115.107 -0.951 . . . . 0.0 108.514 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.643 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 60.1 m -116.68 154.43 30.6 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -178.242 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.63 ' OD1' ' HB ' ' A' ' 41' ' ' THR . 12.7 p30 -152.3 159.19 43.53 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.519 177.527 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.433 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.9 OUTLIER -54.88 133.42 66.7 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.733 176.633 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.709 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 54.8 Cg_exo -49.86 -31.42 26.53 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.557 2.838 . . . . 0.0 113.607 -172.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.25 -19.93 49.92 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -177.012 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.96 -53.18 3.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.772 -177.438 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.63 ' HB ' ' OD1' ' A' ' 36' ' ' ASN . 0.4 OUTLIER -69.4 -25.07 63.96 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.541 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.709 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 2.1 m120 -91.98 15.78 12.5 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.041 -177.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -49.4 -33.73 14.56 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.894 -179.175 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.782 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 6.2 t70 -119.3 152.35 36.87 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.678 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.0 -24.32 40.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.396 -175.357 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 tp -85.36 -36.28 20.85 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 175.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.782 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -52.3 -39.88 61.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.542 175.983 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.06 -18.25 65.14 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.145 -177.206 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -97.32 -25.88 10.63 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.065 -0.588 . . . . 0.0 111.837 176.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 94.2 mt -75.68 -9.04 58.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.771 0.319 . . . . 0.0 110.778 179.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.461 HD21 HG23 ' A' ' 41' ' ' THR . 0.1 OUTLIER -65.81 -13.53 59.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.007 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.433 ' HA3' ' HB2' ' A' ' 56' ' ' LEU . . . -148.91 94.05 0.15 Allowed Glycine 0 N--CA 1.444 -0.815 0 N-CA-C 111.228 -0.749 . . . . 0.0 111.228 176.673 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.466 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -81.42 63.46 5.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.02 0.438 . . . . 0.0 111.459 -171.648 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 154.49 52.94 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.546 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 60.75 43.69 11.95 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.919 0.39 . . . . 0.0 111.619 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.727 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 0.1 OUTLIER -85.95 -174.36 5.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.935 0.398 . . . . 0.0 111.084 179.712 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.525 ' H ' HD23 ' A' ' 56' ' ' LEU . 10.5 t-20 -132.88 -178.28 4.88 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.201 -178.478 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.545 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -107.42 -146.3 12.73 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.717 -0.674 . . . . 0.0 112.156 -177.282 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 12.9 tp -65.69 145.96 55.38 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.0 t -53.93 109.77 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.842 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.29 -51.08 4.44 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.81 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 24.6 t30 -81.32 94.35 6.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.307 0.575 . . . . 0.0 111.172 -176.697 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.73 129.08 38.68 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.324 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 131.95 -51.17 0.86 Allowed Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.793 178.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.89 68.82 7.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.878 0.371 . . . . 0.0 110.95 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.545 ' HA ' ' HA2' ' A' ' 58' ' ' GLY . . . -79.95 137.77 36.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.745 176.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.3 m -110.83 141.51 44.09 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.109 0.48 . . . . 0.0 111.774 -174.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.905 ' HB3' HD22 ' A' ' 81' ' ' LEU . . . -104.76 156.16 18.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.905 178.165 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.705 ' HD2' ' HB2' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -111.7 -178.42 3.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.201 -172.939 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.61 -37.96 83.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.695 0.283 . . . . 0.0 111.342 -177.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -41.39 94.9 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.473 0.654 . . . . 0.0 110.103 177.583 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.472 ' HB3' ' HB1' ' A' ' 68' ' ' ALA . 1.1 mp -72.57 -17.08 61.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.162 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -66.03 -34.09 67.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 173.575 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -101.01 -39.33 7.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.55 -174.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.8 -29.68 20.08 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -174.8 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.482 HD13 ' HA ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -147.14 -17.82 0.4 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 111.871 0.322 . . . . 0.0 111.871 -178.479 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.41 51.96 5.01 Favored Glycine 0 CA--C 1.519 0.304 0 C-N-CA 119.935 -1.126 . . . . 0.0 112.406 178.25 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.02 84.62 0.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.107 0.479 . . . . 0.0 111.018 -178.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.451 ' HG ' ' H ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -69.55 -6.24 29.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.565 -174.693 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -77.72 -16.49 58.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.825 0.345 . . . . 0.0 110.735 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.905 HD22 ' HB3' ' A' ' 68' ' ' ALA . 0.4 OUTLIER -105.54 -25.09 12.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.517 -175.907 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.44 138.85 24.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.0 0.428 . . . . 0.0 111.007 -177.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.454 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 5.8 t70 -117.85 159.26 23.37 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 174.229 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.508 ' CE1' ' HA2' ' A' ' 88' ' ' GLY . 23.8 t-80 -111.58 110.91 21.56 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.204 0.526 . . . . 0.0 110.858 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.3 p -97.07 -167.81 1.6 Allowed 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.093 177.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.435 ' HG3' ' H ' ' A' ' 86' ' ' GLU . 16.6 mt-10 -51.12 -44.06 61.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.531 177.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.413 ' CD ' ' HB2' ' A' ' 17' ' ' ALA . 48.9 mp0 -72.83 -75.42 0.14 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.842 0.353 . . . . 0.0 111.148 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.508 ' HA2' ' CE1' ' A' ' 84' ' ' HIS . . . -168.65 -151.48 7.18 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.617 -176.159 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -69.82 107.9 1.97 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 123.128 2.552 . . . . 0.0 111.703 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.468 HG11 ' HB3' ' A' ' 17' ' ' ALA . 1.0 OUTLIER -125.61 -173.3 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.014 -176.726 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 50.1 t -67.72 134.13 50.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.41 177.731 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.454 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttt -73.65 -36.04 65.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.792 -178.088 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.522 ' HB3' HG13 ' A' ' 94' ' ' ILE . 4.8 m-80 -146.66 -95.22 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -171.102 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.522 HG13 ' HB3' ' A' ' 93' ' ' ASN . 3.5 mt -93.57 132.86 36.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.888 -168.701 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.49 130.82 36.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.501 177.03 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.643 ' HB3' ' SG ' ' A' ' 35' ' ' CYS . . . -154.52 175.8 13.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.051 0.453 . . . . 0.0 111.476 -178.53 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.97 125.69 54.68 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.555 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.621 ' HB3' ' HD2' ' A' ' 69' ' ' LYS . 15.3 t -144.22 129.01 9.38 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.18 -176.634 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.469 ' O ' HD21 ' A' ' 56' ' ' LEU . 67.5 Cg_endo -87.86 129.83 2.56 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 122.95 2.433 . . . . 0.0 112.818 -176.832 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.687 ' HG2' ' HE2' ' A' ' 69' ' ' LYS . 4.7 mm-40 -77.31 97.28 4.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.109 0.48 . . . . 0.0 110.691 176.518 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.463 ' O ' ' HB ' ' A' ' 102' ' ' THR . . . 169.67 -53.01 0.2 Allowed Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 177.631 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.727 ' HA ' ' HA ' ' A' ' 56' ' ' LEU . 5.8 t 177.07 -176.33 0.14 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.634 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 71.95 158.96 0.2 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.343 0.592 . . . . 0.0 111.099 -176.487 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.497 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 1.0 OUTLIER -76.17 173.88 10.79 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.498 -175.755 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.5 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -111.25 150.65 29.3 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.931 -179.467 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.467 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 6.0 m -106.6 133.48 51.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.891 0.377 . . . . 0.0 110.64 -177.791 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.98 119.55 39.67 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.316 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -114.28 13.44 8.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.062 0.458 . . . . 0.0 110.765 -178.224 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.324 -0.526 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.312 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.468 ' HA ' HD22 ' A' ' 12' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.354 0 CA-C-O 121.107 0.479 . . . . 0.0 110.314 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.68 -28.72 69.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.629 -179.103 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.06 -27.06 61.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.184 0.516 . . . . 0.0 111.074 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -88.22 68.17 8.94 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.448 -176.401 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.51 -31.47 69.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.6 -29.45 70.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.934 174.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.584 ' HB2' HG12 ' A' ' 90' ' ' VAL . 69.9 t80 -84.47 -29.62 25.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.974 0.416 . . . . 0.0 110.466 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.43 -4.46 22.65 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.975 -178.158 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.47 -24.78 31.64 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 176.324 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.542 ' HG2' HG21 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -73.32 -27.34 61.47 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.858 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.12 -11.27 60.77 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.846 178.325 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -101.8 -47.54 4.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.103 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -72.08 -44.87 43.66 Favored Glycine 0 C--N 1.33 0.199 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.8 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.36 136.4 32.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.742 0.306 . . . . 0.0 110.918 -178.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.74 96.0 7.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.882 0.372 . . . . 0.0 111.618 -177.463 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.428 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 98.9 m -144.47 -178.85 6.19 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 176.8 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 31.8 t30 -102.66 134.78 45.46 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.4 p -62.57 -29.27 46.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 O-C-N 123.214 0.321 . . . . 0.0 111.334 -177.312 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -88.84 8.35 79.77 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.734 -0.746 . . . . 0.0 111.754 177.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.3 m -149.63 42.94 0.91 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.084 0.468 . . . . 0.0 110.408 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -97.65 140.14 18.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 176.397 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.479 ' CB ' ' HB3' ' A' ' 98' ' ' CYS . . . -148.67 160.88 42.73 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 121.194 0.521 . . . . 0.0 111.717 -173.419 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 21.5 m -114.6 131.98 56.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.158 173.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.429 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 2.8 m -122.23 164.94 16.98 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.297 -178.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.573 ' HB2' HD12 ' A' ' 81' ' ' LEU . 1.1 t30 -147.42 159.91 43.17 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.258 -179.571 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.05 142.1 37.1 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.786 175.103 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.508 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 83.9 Cg_exo -47.6 -44.84 24.99 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.858 3.038 . . . . 0.0 114.73 -173.079 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.47 -15.32 62.53 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -173.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.569 ' CD ' ' HZ1' ' A' ' 92' ' ' LYS . 4.7 mt-10 -98.59 -48.52 4.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.539 0.685 . . . . 0.0 109.631 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.416 HG22 HD22 ' A' ' 51' ' ' LEU . 3.6 m -61.13 -34.6 75.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.11 177.238 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.508 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.1 m-80 -104.93 15.2 28.17 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.779 -177.592 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -53.83 -40.16 66.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.481 -177.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 1.095 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.1 t70 -102.66 146.93 27.46 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.74 -179.343 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -34.19 77.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.86 -177.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 46' ' ' LEU . 6.3 tp -92.28 -24.29 19.02 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.089 0.471 . . . . 0.0 110.736 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 1.095 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -58.85 -31.76 68.82 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.515 -177.613 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.44 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -63.01 -11.76 21.28 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -176.537 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -117.42 -21.49 4.37 Favored Glycine 0 C--N 1.331 0.301 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 172.341 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.2 mp -84.3 -7.21 59.4 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.708 ' HA ' ' HG ' ' A' ' 78' ' ' LEU . 0.3 OUTLIER -70.55 -9.0 55.7 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.301 0.572 . . . . 0.0 109.975 179.08 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.637 ' HA2' HD23 ' A' ' 72' ' ' LEU . . . -128.44 -125.99 2.82 Favored Glycine 0 N--CA 1.438 -1.224 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 176.151 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -168.76 -24.6 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.358 0.599 . . . . 0.0 109.669 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -126.1 -157.98 9.76 Favored Glycine 0 N--CA 1.443 -0.878 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 172.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.459 ' O ' HG22 ' A' ' 102' ' ' THR . 0.2 OUTLIER -75.53 64.79 1.67 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.182 0.515 . . . . 0.0 110.927 179.761 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.701 ' HA ' ' O ' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -65.55 150.62 48.1 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.778 178.294 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -109.22 177.89 4.62 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 171.03 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -110.18 -154.18 14.38 Favored Glycine 0 CA--C 1.504 -0.603 0 C-N-CA 120.361 -0.923 . . . . 0.0 111.993 -173.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.683 ' HB3' ' HB2' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -65.46 139.54 58.52 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 178.37 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.2 m -56.77 96.48 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.5 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.11 19.12 56.46 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.883 178.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.683 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 1.1 t-20 -127.92 95.03 4.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.182 0.515 . . . . 0.0 109.92 178.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.33 88.4 3.14 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.612 -176.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 153.96 -43.74 0.6 Allowed Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.968 -0.634 . . . . 0.0 111.798 176.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.6 98.94 7.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.947 0.404 . . . . 0.0 110.675 179.007 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.51 171.58 9.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.982 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 79.4 m -134.68 140.08 45.73 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.273 -175.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -104.81 124.73 49.94 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.51 ' HG2' ' H ' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -85.19 157.17 20.71 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.259 -175.465 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.84 -36.31 72.11 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 m -63.55 -31.91 73.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.191 0.52 . . . . 0.0 110.44 176.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.714 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 0.3 OUTLIER -85.88 -18.82 31.72 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.897 -177.57 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.77 -37.98 81.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 172.115 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -79.8 -6.84 58.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.667 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.799 ' HB3' HD12 ' A' ' 76' ' ' LEU . 4.0 tp60 -95.1 -42.3 8.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.245 -178.137 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.799 HD12 ' HB3' ' A' ' 75' ' ' GLN . 4.2 mp -134.79 -65.52 0.63 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.767 -177.437 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.58 50.27 1.86 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.35 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.708 ' HG ' ' HA ' ' A' ' 51' ' ' LEU . 1.8 mm? -59.66 107.03 0.54 Allowed 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 122.613 0.365 . . . . 0.0 110.797 -178.571 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.435 ' HG ' ' H ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.58 17.1 0.16 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.428 -171.941 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -93.13 -29.23 15.87 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.225 0.536 . . . . 0.0 109.659 173.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.573 HD12 ' HB2' ' A' ' 36' ' ' ASN . 0.5 OUTLIER -105.11 -1.7 25.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.664 -173.016 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.489 ' C ' ' HG2' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -123.6 137.61 56.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.292 0.568 . . . . 0.0 111.295 -178.955 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -90.19 174.06 7.82 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 173.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.7 72.28 1.4 Allowed 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 122.039 0.923 . . . . 0.0 110.508 -176.157 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 98.0 m -72.76 158.57 35.32 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 114.099 -1.409 . . . . 0.0 109.665 175.78 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -53.43 -35.59 60.62 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -177.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.03 -63.82 1.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.468 0.652 . . . . 0.0 110.327 177.379 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -173.37 -174.56 40.49 Favored Glycine 0 N--CA 1.44 -1.072 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -69.96 132.34 22.81 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.032 1.821 . . . . 0.0 110.846 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.584 HG12 ' HB2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -133.57 -178.53 2.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.934 -169.411 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.43 133.7 50.04 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.256 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.569 ' HZ1' ' CD ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -71.67 -46.84 57.66 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 -177.074 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -150.68 -70.54 0.18 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.837 -171.474 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.416 ' HB ' ' HB2' ' A' ' 35' ' ' CYS . 15.7 mt -98.88 120.91 48.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.183 -174.0 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.542 HG21 ' HG2' ' A' ' 21' ' ' GLN . 7.6 p -93.51 129.96 43.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.125 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.429 ' HB3' ' SG ' ' A' ' 35' ' ' CYS . . . -148.81 169.72 19.84 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.398 0.618 . . . . 0.0 111.561 -174.674 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.428 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -105.16 115.97 31.17 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.217 175.561 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.491 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 38.9 t -136.38 126.3 16.08 Favored Pre-proline 0 C--N 1.319 -0.723 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.87 -173.4 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -67.21 134.38 33.61 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.721 2.281 . . . . 0.0 111.462 178.004 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.451 ' HA ' ' HG3' ' A' ' 69' ' ' LYS . 1.3 tt0 -67.03 118.23 10.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.106 0.479 . . . . 0.0 109.894 176.65 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.701 ' O ' ' HA ' ' A' ' 56' ' ' LEU . . . 113.9 -115.93 3.73 Favored Glycine 0 N--CA 1.437 -1.296 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -176.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.459 HG22 ' O ' ' A' ' 55' ' ' LEU . 66.8 p -98.83 -174.84 2.89 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 123.659 0.27 . . . . 0.0 110.802 -173.071 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.1 m 74.07 151.67 0.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.686 0.755 . . . . 0.0 112.058 177.707 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -76.34 159.77 30.22 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.027 -175.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.491 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.4 141.41 46.17 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.893 -179.75 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.42 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 1.7 m -99.37 135.2 35.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.164 0.507 . . . . 0.0 111.185 -178.355 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -100.52 112.01 24.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.537 176.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 1.8 m -94.45 21.71 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -170.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.1 t0 . . . . . 0 C--N 1.32 -0.692 0 CA-C-O 121.34 0.59 . . . . 0.0 111.108 177.381 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.475 0.805 0 CA-C-O 120.913 0.387 . . . . 0.0 110.94 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.407 HD22 ' HA ' ' A' ' 2' ' ' LEU . 0.2 OUTLIER -132.97 98.64 15.69 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -178.837 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -64.3 132.34 33.45 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.897 2.398 . . . . 0.0 113.199 -175.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 65.19 47.36 2.45 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.243 173.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 p -111.4 100.9 9.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.02 175.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.04 16.93 9.71 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.717 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -93.71 116.46 28.95 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.784 -178.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.01 18.72 20.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.304 0.573 . . . . 0.0 109.997 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -124.51 141.34 52.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.182 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -134.79 49.46 2.22 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.102 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.3 mttm -95.94 -176.0 3.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.231 -178.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.492 ' C ' ' H ' ' A' ' 14' ' ' THR . 7.8 mp -81.39 58.94 3.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.783 -0.189 . . . . 0.0 110.905 -176.048 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 68.96 -33.4 0.24 Allowed 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.362 0.665 . . . . 0.0 111.536 -177.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.492 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -153.62 -51.36 0.1 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.066 178.146 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.4 m 66.73 -78.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.813 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 52.23 -87.71 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.636 0.585 . . . . 0.0 110.964 -177.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.745 ' HB1' ' HD2' ' A' ' 116' ' ' LYS . . . -60.09 -39.01 84.62 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.63 174.102 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -69.18 -25.75 64.5 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.044 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.59 -40.28 66.69 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.942 175.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.584 ' NZ ' ' HB2' ' A' ' 118' ' ' GLU . 0.2 OUTLIER -62.83 -35.72 80.84 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 174.127 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.662 ' HG3' ' HB3' ' A' ' 116' ' ' LYS . 1.0 OUTLIER -61.47 -46.9 88.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.211 174.365 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.83 -18.28 64.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.739 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.08 -33.92 13.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.87 178.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.66 -24.4 58.5 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.3 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.71 133.47 52.75 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.801 0.334 . . . . 0.0 110.345 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.33 96.55 4.64 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.104 0.478 . . . . 0.0 111.383 -178.061 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.4 m -142.04 -177.78 5.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.057 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -117.2 157.34 26.17 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.288 -179.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.419 HG22 ' H ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -68.36 -48.54 72.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -173.555 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.37 9.37 61.58 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.812 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 m -139.57 31.4 2.08 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.164 0.507 . . . . 0.0 110.034 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -90.54 127.93 42.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.383 -179.489 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.88 169.11 21.27 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.085 0.469 . . . . 0.0 111.474 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.432 ' O ' HD22 ' A' ' 81' ' ' LEU . 8.8 t -125.72 140.12 52.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.194 172.434 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.605 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 0.3 OUTLIER -121.91 138.99 54.19 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.639 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.492 HD22 ' HB2' ' A' ' 40' ' ' GLU . 10.1 t30 -116.16 160.18 20.73 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.77 -179.406 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.91 126.92 3.22 Favored Pre-proline 0 C--O 1.237 0.443 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.111 172.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.46 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 7.9 Cg_endo -49.69 -38.74 46.74 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.909 3.072 . . . . 0.0 114.198 -171.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.74 -23.96 66.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.758 0.313 . . . . 0.0 111.666 -175.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.492 ' HB2' HD22 ' A' ' 36' ' ' ASN . 51.2 mm-40 -96.49 -41.76 8.42 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 0.0 110.27 -178.369 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.451 ' HA ' ' HB1' ' A' ' 80' ' ' ALA . 2.0 m -62.44 -33.65 75.24 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.447 0.641 . . . . 0.0 110.468 175.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.6 OUTLIER -104.13 16.01 27.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.5 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -52.97 -48.58 67.31 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.212 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 1.001 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 7.4 t70 -94.53 136.12 35.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.885 175.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -27.44 67.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.103 0.478 . . . . 0.0 110.493 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.01 -26.4 29.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.251 178.052 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 1.001 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -60.13 -37.06 78.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.331 178.39 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.32 -34.07 70.19 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.09 179.043 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -94.11 -12.91 55.83 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.104 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -77.01 -33.98 57.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.022 0.439 . . . . 0.0 110.664 -178.217 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.453 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.6 OUTLIER -73.43 -30.22 63.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.151 0.5 . . . . 0.0 110.748 179.162 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.664 ' HA2' ' HG ' ' A' ' 56' ' ' LEU . . . -91.31 60.44 2.97 Favored Glycine 0 N--CA 1.443 -0.898 0 C-N-CA 121.058 -0.592 . . . . 0.0 112.429 -177.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.81 -24.86 67.92 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.91 0.386 . . . . 0.0 111.034 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -118.12 22.71 9.59 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.542 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.592 ' O ' HG23 ' A' ' 102' ' ' THR . 21.4 tp 66.27 44.18 2.57 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.162 0.506 . . . . 0.0 110.624 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.664 ' HG ' ' HA2' ' A' ' 52' ' ' GLY . 0.2 OUTLIER -86.07 178.28 7.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.091 -177.648 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -120.06 -176.08 3.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.744 -175.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -100.92 -154.36 26.81 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.295 -174.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.573 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 8.2 tp -66.68 140.38 57.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.831 0.316 . . . . 0.0 110.537 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.65 97.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.723 -178.21 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 103.16 -10.36 54.88 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.875 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.573 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 2.6 t-20 -129.27 93.55 3.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.187 0.518 . . . . 0.0 110.85 -178.402 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 28.6 m -75.1 93.77 2.81 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.712 176.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 173.4 -58.01 0.14 Allowed Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 178.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.44 84.01 5.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.979 0.418 . . . . 0.0 110.208 177.094 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.63 155.89 29.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.054 177.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.7 m -122.33 131.53 53.95 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.891 0.377 . . . . 0.0 111.422 -177.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.711 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -105.13 134.57 48.01 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.879 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.828 ' HD2' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -89.2 167.19 13.29 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.703 -174.066 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.483 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -58.98 -32.87 70.05 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.413 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -37.85 71.2 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.413 0.625 . . . . 0.0 109.519 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.421 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -65.8 -31.93 73.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.046 175.719 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.483 HD12 ' HA ' ' A' ' 70' ' ' ALA . 3.9 mt -65.37 -35.67 75.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.318 177.528 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -84.08 -6.49 59.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.064 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -94.78 -43.86 8.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.292 0.568 . . . . 0.0 109.9 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.2 mp -132.43 -53.87 0.96 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.562 -176.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.18 51.17 2.28 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.034 -179.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.524 ' H ' HD22 ' A' ' 78' ' ' LEU . 1.9 mm? -54.04 100.45 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 122.683 0.393 . . . . 0.0 111.432 -177.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.488 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -76.17 1.72 15.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.55 -176.426 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.451 ' HB1' ' HA ' ' A' ' 41' ' ' THR . . . -72.28 -33.64 67.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.917 0.389 . . . . 0.0 110.946 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.711 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.8 OUTLIER -119.61 4.53 11.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.916 0.389 . . . . 0.0 111.431 -176.837 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.601 HG23 HD12 ' A' ' 81' ' ' LEU . 97.0 t -109.0 138.8 34.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.887 178.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.896 ' HB2' ' HD3' ' A' ' 92' ' ' LYS . 29.2 t70 -123.43 153.19 40.77 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.064 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -118.14 132.35 56.35 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.4 0.619 . . . . 0.0 111.586 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.476 HG23 ' H ' ' A' ' 87' ' ' GLU . 11.7 t -138.66 174.76 10.19 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.812 -1.085 . . . . 0.0 108.111 174.054 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -68.43 -16.79 64.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.336 0.589 . . . . 0.0 110.716 -178.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.476 ' H ' HG23 ' A' ' 85' ' ' THR . 40.3 mp0 -77.64 -5.48 50.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.553 176.413 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 114.69 -174.38 15.39 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.188 -0.529 . . . . 0.0 112.652 177.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -65.85 119.75 6.82 Favored 'Trans proline' 0 N--CA 1.463 -0.274 0 C-N-CA 123.037 2.491 . . . . 0.0 111.18 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 3.0 m -133.25 179.91 3.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.921 0.391 . . . . 0.0 111.528 -172.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.57 146.41 50.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.821 177.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.896 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -86.3 -37.52 18.45 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.327 175.424 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.426 ' O ' ' HA3' ' A' ' 114' ' ' GLY . 6.1 m-80 -150.57 -87.29 0.07 Allowed 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 120.929 0.395 . . . . 0.0 111.601 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 4.7 mt -92.94 131.27 40.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.563 -169.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.6 p -100.14 132.1 46.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.511 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.605 ' HB3' ' SG ' ' A' ' 35' ' ' CYS . . . -154.33 167.12 31.03 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 120.834 0.35 . . . . 0.0 111.449 -177.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.79 126.35 52.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.019 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.828 ' HB3' ' HD2' ' A' ' 69' ' ' LYS . 11.5 t -135.93 134.35 20.42 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.137 -171.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -82.78 142.75 11.49 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 122.898 2.398 . . . . 0.0 113.042 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -81.23 125.44 30.3 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 169.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 134.72 -113.37 1.13 Allowed Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -175.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -146.85 105.49 3.82 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 117.136 0.468 . . . . 0.0 111.874 179.279 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 171.73 168.64 0.1 Allowed 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 124.813 1.245 . . . . 0.0 108.764 172.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -80.07 171.45 15.07 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.418 -178.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.4 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.04 143.39 43.13 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.272 -178.822 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.467 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 3.7 m -95.26 136.54 25.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.712 -177.072 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.549 ' HB2' HD11 ' A' ' 59' ' ' LEU . . . -111.07 124.14 51.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.058 0.456 . . . . 0.0 111.135 -177.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -105.89 11.27 8.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.273 -178.141 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -115.53 -81.06 0.61 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.003 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 76.67 -53.54 0.58 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.815 0.846 . . . . 0.0 112.307 174.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.17 23.52 7.66 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.848 -175.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -109.68 -14.3 14.42 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.486 -0.864 . . . . 0.0 111.99 178.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . 72.15 22.4 3.65 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.516 0.726 . . . . 0.0 111.511 176.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLY . . . . . 0.426 ' HA3' ' O ' ' A' ' 93' ' ' ASN . . . 56.64 54.94 32.61 Favored Glycine 0 C--N 1.331 0.257 0 CA-C-N 116.07 -0.514 . . . . 0.0 113.287 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 4.9 t -83.0 154.04 24.66 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.0 0.428 . . . . 0.0 110.546 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.745 ' HD2' ' HB1' ' A' ' 17' ' ' ALA . 0.0 OUTLIER -130.72 145.47 51.95 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.753 178.081 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -71.51 95.81 1.44 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.393 0.433 . . . . 0.0 110.043 177.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.584 ' HB2' ' NZ ' ' A' ' 20' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.532 -175.462 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 120.619 0.247 . . . . 0.0 111.024 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.26 117.75 52.54 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-O 120.976 0.417 . . . . 0.0 110.484 179.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -79.23 3.38 7.5 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 122.64 2.227 . . . . 0.0 112.754 -178.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -100.17 -9.9 22.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.381 -178.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.91 -59.37 2.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.874 0.369 . . . . 0.0 111.284 -179.087 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.61 -113.4 0.21 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.348 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 63.7 21.38 12.67 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 123.529 0.518 . . . . 0.0 111.323 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -129.76 30.87 4.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.235 -177.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -101.13 -88.38 0.37 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.718 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -153.22 89.91 1.39 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.931 0.396 . . . . 0.0 110.854 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.2 138.55 33.58 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.24 178.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.463 HD11 ' HD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -94.48 71.5 3.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.307 0.575 . . . . 0.0 109.671 177.305 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -155.66 -46.81 0.08 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.09 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.95 -22.01 60.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.142 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.409 ' HB3' ' O ' ' A' ' 89' ' ' PRO . 0.0 OUTLIER -78.68 64.07 3.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.289 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.39 -31.88 70.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.225 0.536 . . . . 0.0 110.409 178.103 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 1.0 ' HB1' ' HB2' ' A' ' 116' ' ' LYS . . . -65.76 -31.48 72.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.147 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.463 ' HD2' HD11 ' A' ' 12' ' ' LEU . 60.2 t80 -66.38 -40.51 89.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.016 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.67 -27.29 50.81 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.144 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.49 ' NZ ' ' HB3' ' A' ' 118' ' ' GLU . 2.9 mttm -55.67 -43.25 76.17 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.575 0.702 . . . . 0.0 109.212 173.522 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.435 ' OE1' ' HA ' ' A' ' 18' ' ' PHE . 1.3 mt-30 -56.4 -49.0 75.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.346 -1.297 . . . . 0.0 111.147 175.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.53 ' HB1' HD11 ' A' ' 32' ' ' ILE . . . -82.92 0.61 43.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.137 -173.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -78.1 -15.08 59.2 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.753 0.311 . . . . 0.0 110.662 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.73 -8.75 55.55 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.93 -0.653 . . . . 0.0 111.806 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.31 173.95 6.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.509 0.195 . . . . 0.0 110.553 -179.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.21 97.11 5.44 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.939 0.4 . . . . 0.0 110.949 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.507 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -143.25 155.13 44.42 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.238 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -95.17 170.09 9.64 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.628 0.251 . . . . 0.0 110.635 -176.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.8 p -68.02 126.94 28.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 110.126 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.38 -33.63 5.03 Favored Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -176.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -94.23 25.97 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.218 0.532 . . . . 0.0 110.324 177.563 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.53 HD11 ' HB1' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -112.68 130.17 66.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.113 179.783 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.74 ' HB3' ' SG ' ' A' ' 98' ' ' CYS . . . -149.75 -179.63 7.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.686 0.755 . . . . 0.0 112.524 -172.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.9 t -123.42 132.96 54.11 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.245 175.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.446 ' HB2' HG12 ' A' ' 94' ' ' ILE . 3.9 m -100.36 121.29 41.27 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -113.56 148.0 36.94 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.469 -177.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.441 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 45.4 m -54.1 131.13 59.67 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.437 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.451 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 51.9 Cg_exo -53.27 -37.97 81.32 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.489 2.793 . . . . 0.0 114.157 -171.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.64 -18.02 65.15 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.898 0.38 . . . . 0.0 111.915 -175.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -102.43 -38.86 7.4 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.411 ' O ' HD22 ' A' ' 47' ' ' LEU . 1.8 m -62.49 -30.02 70.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.657 175.405 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.7 OUTLIER -104.72 13.3 31.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.045 -179.655 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -61.23 -42.3 98.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.336 0.589 . . . . 0.0 110.556 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.933 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 30.3 t0 -96.09 130.4 43.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.6 m -69.51 -23.78 63.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.091 0.472 . . . . 0.0 110.315 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -33.39 62.36 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.199 174.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.933 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -64.48 -32.39 74.0 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.416 178.974 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.463 ' HA ' HD21 ' A' ' 51' ' ' LEU . 4.2 t -61.65 -22.04 64.93 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.138 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -106.5 -9.87 30.28 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.439 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.699 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 1.1 mp -82.9 -23.33 33.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.921 0.391 . . . . 0.0 110.574 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.463 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.5 OUTLIER -77.34 -29.03 53.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.094 0.474 . . . . 0.0 110.33 176.503 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -98.43 83.37 0.65 Allowed Glycine 0 N--CA 1.441 -1.015 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.004 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -77.41 -6.64 54.12 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.397 0.618 . . . . 0.0 109.944 177.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.3 -126.14 1.27 Allowed Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.023 176.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.431 ' HB2' HG23 ' A' ' 102' ' ' THR . 0.0 OUTLIER -107.66 55.35 0.65 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.291 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.744 HD11 ' HZ1' ' A' ' 69' ' ' LYS . 3.3 mt -79.92 169.73 17.48 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.786 -172.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.462 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 19.4 t-20 -131.59 -179.45 5.39 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.94 175.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.579 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -99.81 -133.24 8.03 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.847 -175.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.801 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 7.9 tp -80.23 152.64 29.0 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.05 89.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.188 0.518 . . . . 0.0 111.152 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.27 -2.27 57.7 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.7 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.801 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 47.4 t30 -124.86 102.28 7.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.018 0.437 . . . . 0.0 110.877 -178.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.42 73.98 6.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.15 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.58 -55.73 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.909 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.64 79.47 4.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.03 0.443 . . . . 0.0 110.823 178.431 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.579 ' HA ' ' HA2' ' A' ' 58' ' ' GLY . . . -74.72 124.89 27.58 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 173.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.8 m -110.62 128.79 55.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.11 0.481 . . . . 0.0 110.271 -175.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.726 ' HB3' HD22 ' A' ' 81' ' ' LEU . . . -106.21 144.65 32.61 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.804 -174.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.744 ' HZ1' HD11 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -103.51 -174.92 2.66 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.38 -175.424 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.71 -28.57 63.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.565 -178.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -63.95 -42.31 97.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.468 0.651 . . . . 0.0 110.233 177.945 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.474 ' CB ' ' HB1' ' A' ' 68' ' ' ALA . 0.8 OUTLIER -77.26 -35.89 54.87 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.823 -179.95 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.417 HG12 HG21 ' A' ' 82' ' ' VAL . 3.5 mt -65.54 -37.25 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.358 -179.213 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -72.91 -41.32 64.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.929 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 71' ' ' SER . 0.4 OUTLIER -76.4 -53.19 8.51 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.328 -173.468 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.484 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -106.19 -44.52 4.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.25 -172.839 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.94 50.24 7.07 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.194 -1.003 . . . . 0.0 112.504 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.59 106.01 0.72 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 122.332 0.253 . . . . 0.0 111.362 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.6 OUTLIER -71.01 -6.53 39.61 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.891 -177.228 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -86.74 -13.75 44.36 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.906 0.384 . . . . 0.0 110.387 177.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.726 HD22 ' HB3' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -108.62 -33.96 6.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.083 -176.331 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.417 HG21 HG12 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -108.46 137.32 40.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.69 179.805 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.431 ' O ' ' HA ' ' A' ' 89' ' ' PRO . 11.3 t70 -98.18 176.01 5.88 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 175.236 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.91 112.19 7.32 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.946 0.403 . . . . 0.0 111.285 -175.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.473 ' HB ' ' OE1' ' A' ' 86' ' ' GLU . 1.2 p -118.82 -167.64 1.41 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.802 177.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.473 ' OE1' ' HB ' ' A' ' 85' ' ' THR . 0.0 OUTLIER -66.16 -33.27 75.39 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 177.588 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.41 ' CD ' ' HB2' ' A' ' 17' ' ' ALA . 28.0 mt-10 -80.02 4.8 15.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.437 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 103.8 -155.48 17.75 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.764 173.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.431 ' HA ' ' O ' ' A' ' 83' ' ' ASP . 73.2 Cg_endo -73.4 126.13 10.73 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.876 2.384 . . . . 0.0 111.27 177.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -133.12 175.07 12.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.29 -173.137 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.07 116.96 9.29 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.997 178.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.5 tttp -76.19 -25.11 54.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.279 0.562 . . . . 0.0 110.433 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -133.02 -106.21 0.25 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.861 -176.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.446 HG12 ' HB2' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -113.69 149.11 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.831 0.348 . . . . 0.0 111.042 -174.18 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 1.5 t -80.87 144.75 10.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.556 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -154.2 170.2 21.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.03 0.443 . . . . 0.0 111.763 -177.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.507 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.6 m -124.33 108.42 12.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.0 177.244 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.74 ' SG ' ' HB3' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -127.85 141.71 42.0 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.243 -174.017 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -87.81 154.57 7.38 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.165 2.576 . . . . 0.0 113.099 -179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.45 ' CD ' ' HZ2' ' A' ' 69' ' ' LYS . 3.6 tp10 -98.26 117.62 33.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.401 173.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 145.06 -67.78 0.42 Allowed Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.008 177.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.431 HG23 ' HB2' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -157.4 177.33 11.55 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.561 HG22 ' H ' ' A' ' 104' ' ' ASN . 1.4 m 69.79 167.59 0.29 Allowed 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.603 0.716 . . . . 0.0 111.919 177.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.561 ' H ' HG22 ' A' ' 103' ' ' THR . 4.5 p30 -89.88 -179.29 5.69 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.542 -171.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 98' ' ' CYS . 7.2 t -112.79 148.69 34.29 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.745 -175.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.0 m -104.26 138.34 29.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.953 0.406 . . . . 0.0 110.204 178.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.86 117.79 27.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.817 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -121.49 26.41 3.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.953 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -61.23 -53.05 61.82 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.006 176.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 70.99 10.78 6.98 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 114.881 -1.054 . . . . 0.0 113.145 170.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -122.48 -42.79 2.32 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.1 0.476 . . . . 0.0 110.761 177.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 110.0 4.53 29.45 Favored Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 111.282 -0.727 . . . . 0.0 111.282 -178.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -163.79 117.35 1.49 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.461 -0.37 . . . . 0.0 110.013 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.58 -48.27 86.84 Favored Glycine 0 N--CA 1.453 -0.169 0 C-N-CA 121.27 -0.491 . . . . 0.0 112.891 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.96 98.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.273 0.629 . . . . 0.0 111.384 -179.193 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 1.0 ' HB2' ' HB1' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -72.01 -23.16 61.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.695 -179.848 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -72.57 119.09 16.31 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.433 176.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.49 ' HB3' ' NZ ' ' A' ' 20' ' ' LYS . 2.9 tm-20 . . . . . 0 C--O 1.251 1.15 0 CA-C-O 117.774 -1.107 . . . . 0.0 108.987 -177.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 120.789 0.328 . . . . 0.0 110.941 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.24 141.6 34.92 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.151 -0.315 . . . . 0.0 110.151 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.73 71.32 3.32 Favored 'Trans proline' 0 C--O 1.233 0.27 0 C-N-CA 122.645 2.23 . . . . 0.0 112.748 -179.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.92 -32.97 72.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.196 176.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.08 150.78 35.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.266 175.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -82.19 53.77 2.35 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.236 0.541 . . . . 0.0 110.849 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.21 79.85 1.27 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.29 0.567 . . . . 0.0 110.912 -178.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.45 -3.84 56.2 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.512 0.672 . . . . 0.0 109.885 178.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.1 p-10 -98.31 -35.46 10.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.971 -1.013 . . . . 0.0 111.218 -175.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -117.6 108.57 15.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.831 0.348 . . . . 0.0 111.247 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.84 157.36 46.2 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.354 178.116 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.02 -9.64 52.78 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.97 174.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.04 -8.7 59.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.608 -177.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.48 6.82 8.94 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.929 0.395 . . . . 0.0 111.559 -177.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 m -61.97 -50.6 71.46 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.422 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 60.72 -73.44 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.743 0.652 . . . . 0.0 112.071 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.5 -28.66 69.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.566 -178.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -62.9 -38.61 91.63 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.183 0.516 . . . . 0.0 110.257 176.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -71.58 -22.06 61.78 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.837 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.468 ' HA ' ' HG2' ' A' ' 23' ' ' GLU . 16.9 mtpp -75.65 -22.25 56.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.723 0.773 . . . . 0.0 109.052 178.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -82.3 -41.95 19.45 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.522 173.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.44 ' HB1' HD11 ' A' ' 32' ' ' ILE . . . -74.69 -17.34 60.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.988 -1.005 . . . . 0.0 112.266 -175.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.468 ' HG2' ' HA ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -77.17 -9.2 58.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.675 0.274 . . . . 0.0 111.039 179.228 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.72 -20.04 58.8 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.669 -0.776 . . . . 0.0 112.216 177.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -125.48 123.29 38.88 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.15 97.67 1.23 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.268 0.556 . . . . 0.0 111.945 -176.04 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.3 m -140.85 152.52 45.18 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 173.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -84.2 153.93 23.36 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -173.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.05 -40.99 84.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -176.01 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.0 -8.86 86.95 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.528 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.1 10.06 12.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.033 0.444 . . . . 0.0 110.803 -178.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.44 HD11 ' HB1' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -90.24 137.94 20.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.626 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . . . -149.64 -178.69 6.58 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -170.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.533 ' HB3' ' HB2' ' A' ' 81' ' ' LEU . 4.4 t -144.43 142.15 30.11 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.278 173.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.844 ' HB2' ' HB ' ' A' ' 94' ' ' ILE . 78.6 m -113.86 158.32 21.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.839 0.352 . . . . 0.0 110.401 179.259 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -145.26 150.72 37.17 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -42.96 139.45 2.15 Favored Pre-proline 0 C--O 1.235 0.33 0 O-C-N 123.733 0.646 . . . . 0.0 112.436 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.517 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 70.4 Cg_exo -51.22 -54.6 5.13 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.596 2.864 . . . . 0.0 113.881 -172.498 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.9 -7.7 23.9 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -172.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -100.56 -51.36 3.63 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.771 0.32 . . . . 0.0 110.718 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.487 HG23 HD21 ' A' ' 51' ' ' LEU . 1.3 m -68.35 -33.3 74.03 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.388 0.613 . . . . 0.0 110.606 178.338 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.517 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.3 m-80 -101.34 14.38 32.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.654 -178.4 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -61.31 -41.91 97.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.379 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.835 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 35.5 t70 -94.96 140.27 30.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.558 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -42.05 97.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.183 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.35 -33.55 73.26 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.862 0.363 . . . . 0.0 110.38 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.835 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -59.9 -36.77 77.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.772 177.415 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.34 -23.28 66.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.933 0.396 . . . . 0.0 110.981 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -98.5 -7.02 56.23 Favored Glycine 0 C--N 1.329 0.189 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.496 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.446 HD21 ' HB3' ' A' ' 78' ' ' LEU . 2.6 tt -82.3 -31.25 30.07 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.009 0.433 . . . . 0.0 110.43 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.487 HD21 HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -75.83 -16.23 60.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.881 179.003 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.59 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -113.81 77.99 0.25 Allowed Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 120.957 -0.64 . . . . 0.0 112.225 -176.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.95 54.06 1.51 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.243 0.544 . . . . 0.0 110.412 177.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.01 -117.74 1.04 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 -177.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.9 mt -117.6 49.14 1.25 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.252 0.549 . . . . 0.0 109.778 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.59 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 1.0 OUTLIER -82.72 175.84 9.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.275 -171.362 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.551 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 6.2 t-20 -135.86 -178.79 5.29 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.299 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -111.79 -132.12 5.87 Favored Glycine 0 C--N 1.315 -0.606 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 -177.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.417 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.1 OUTLIER -66.42 149.8 49.86 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 175.684 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.4 m -65.43 89.72 0.1 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.139 0.495 . . . . 0.0 110.957 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.1 -37.24 3.85 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.604 178.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -89.69 98.62 11.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.912 0.387 . . . . 0.0 111.332 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.69 72.16 2.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.152 179.048 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -169.76 -51.37 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 111.188 -0.765 . . . . 0.0 111.188 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.02 77.73 6.7 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.043 0.449 . . . . 0.0 110.533 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.51 142.45 40.88 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.772 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 4.6 m -123.11 148.41 45.7 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.374 -0.531 . . . . 0.0 111.081 -174.195 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 1.021 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -107.59 139.26 42.4 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.27 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.782 ' HE3' HD22 ' A' ' 72' ' ' LEU . 0.0 OUTLIER -94.3 167.38 11.57 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.402 179.763 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.73 -30.69 69.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.058 0.456 . . . . 0.0 110.083 176.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -27.02 68.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.885 176.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.782 HD22 ' HE3' ' A' ' 69' ' ' LYS . 1.1 tp -91.14 -24.9 19.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.893 0.378 . . . . 0.0 110.733 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 76.2 mt -72.75 -29.17 29.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 172.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.11 -12.82 59.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.006 172.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.604 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 1.1 tp-100 -93.97 -45.31 7.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.342 -178.021 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.0 mp -120.28 -41.94 2.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.688 -174.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.61 50.03 3.25 Favored Glycine 0 CA--C 1.515 0.087 0 C-N-CA 120.105 -1.045 . . . . 0.0 112.13 -178.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.472 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -81.56 164.19 22.1 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.699 0.285 . . . . 0.0 111.64 -175.519 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.56 -0.83 9.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.977 -177.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.56 -35.46 68.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -173.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 1.021 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -116.67 27.07 9.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.761 0.315 . . . . 0.0 111.118 -176.734 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.534 HG11 ' HB3' ' A' ' 89' ' ' PRO . 2.0 t -119.21 137.12 54.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.466 178.278 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.912 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 2.6 t70 -124.13 177.4 5.83 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.987 0.422 . . . . 0.0 111.602 -176.167 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -56.82 133.4 54.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.853 -175.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.526 HG21 ' HA ' ' A' ' 89' ' ' PRO . 5.7 t -159.32 150.28 19.78 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.106 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -108.53 -19.57 13.4 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.951 0.405 . . . . 0.0 110.474 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -90.36 -46.44 8.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.463 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.441 ' O ' HG13 ' A' ' 90' ' ' VAL . . . 174.14 149.3 6.97 Favored Glycine 0 N--CA 1.444 -0.798 0 N-CA-C 111.219 -0.752 . . . . 0.0 111.219 -177.496 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.534 ' HB3' HG11 ' A' ' 82' ' ' VAL . 88.8 Cg_exo -45.61 126.85 9.17 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 123.812 3.008 . . . . 0.0 113.393 -173.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.641 HG11 ' HB3' ' A' ' 116' ' ' LYS . 8.7 m -127.43 -179.81 3.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.409 -176.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.76 135.06 52.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.069 -177.493 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.912 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.5 tttp -85.77 -28.28 24.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.489 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.412 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -148.21 -92.2 0.08 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -169.696 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.844 ' HB ' ' HB2' ' A' ' 35' ' ' CYS . 8.7 mt -101.16 117.15 46.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.091 -168.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.5 t -73.95 125.99 33.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.231 -0.44 . . . . 0.0 109.971 176.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -154.54 176.6 12.19 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.001 -176.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 53.6 m -128.13 127.57 43.27 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.218 177.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.773 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 19.2 m -120.72 137.37 26.3 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.394 -174.076 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -86.33 155.16 9.41 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 122.428 2.086 . . . . 0.0 111.475 170.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.69 156.04 17.55 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 173.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 97.49 -71.55 0.7 Allowed Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.368 -178.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -150.55 172.03 16.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.511 0.196 . . . . 0.0 111.528 -176.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.482 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.2 OUTLIER 74.48 168.04 0.29 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.644 0.778 . . . . 0.0 113.052 172.076 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.551 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.4 OUTLIER -95.35 178.37 5.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.79 -1.095 . . . . 0.0 112.145 -170.239 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 4.4 m -112.89 142.65 45.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.875 -176.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -90.76 148.99 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 174.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -107.04 140.98 38.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.595 0.236 . . . . 0.0 111.098 -176.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -129.81 20.45 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.826 0.346 . . . . 0.0 111.266 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.89 -54.09 12.73 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 176.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 64.66 -79.56 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.352 179.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -166.84 54.38 0.08 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.555 -179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -172.95 84.0 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.452 -0.88 . . . . 0.0 112.905 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -147.11 90.03 1.85 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.867 0.365 . . . . 0.0 110.482 178.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -76.42 -69.19 1.42 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.269 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -166.48 -45.02 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.806 0.336 . . . . 0.0 110.785 177.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.641 ' HB3' HG11 ' A' ' 90' ' ' VAL . 1.7 pttm -177.89 -32.49 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.109 -176.363 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -94.16 84.55 4.47 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.775 177.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 . . . . . 0 C--O 1.251 1.152 0 CA-C-O 118.539 -0.744 . . . . 0.0 110.553 -175.721 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.476 0.855 0 CA-C-O 120.566 0.222 . . . . 0.0 110.631 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.498 HD13 ' HD2' ' A' ' 3' ' ' PRO . 0.6 OUTLIER -59.05 126.87 82.75 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.992 -178.499 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.498 ' HD2' HD13 ' A' ' 2' ' ' LEU . 20.9 Cg_exo -66.71 -11.85 33.56 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 123.119 2.546 . . . . 0.0 112.632 177.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 54.99 38.3 30.29 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.051 176.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -147.45 -90.89 0.09 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.248 177.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -137.31 110.03 7.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.241 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -108.28 -3.54 18.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.954 0.407 . . . . 0.0 111.055 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -155.05 110.48 3.08 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.396 0.617 . . . . 0.0 111.373 -177.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -108.22 170.88 7.73 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.259 -0.882 . . . . 0.0 108.932 171.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.71 69.9 0.67 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.441 0.638 . . . . 0.0 111.569 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.5 mmtt -138.01 155.04 49.24 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 176.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.532 ' HB2' ' OG ' ' A' ' 15' ' ' SER . 5.0 mp -76.55 60.99 1.71 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.589 0.233 . . . . 0.0 110.564 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.53 38.73 30.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.249 -179.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 58.76 50.14 9.14 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.68 -174.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.558 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 0.5 OUTLIER -51.99 -52.54 49.84 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.597 -176.408 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.3 -56.64 0.44 Allowed 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.575 0.75 . . . . 0.0 111.599 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.9 -35.71 81.39 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.017 0.437 . . . . 0.0 110.919 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -68.87 -25.12 64.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.479 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.51 -24.24 60.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.458 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -67.98 -29.8 68.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 176.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.542 ' OE1' ' HA ' ' A' ' 116' ' ' LYS . 0.0 OUTLIER -75.29 -27.66 59.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.406 -1.27 . . . . 0.0 110.519 177.274 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.12 -18.83 62.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.682 -176.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.06 -8.11 13.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.029 0.442 . . . . 0.0 110.563 175.046 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -83.44 -24.94 49.22 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.496 -0.859 . . . . 0.0 111.116 175.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.38 135.01 48.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -74.73 96.91 3.12 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.017 0.437 . . . . 0.0 111.592 -176.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 60.9 m -145.47 136.05 24.27 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 175.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -69.14 144.41 53.86 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.471 -0.196 . . . . 0.0 110.471 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.4 HG23 ' H ' ' A' ' 29' ' ' VAL . 1.6 t -62.95 -36.67 76.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.691 0.282 . . . . 0.0 111.255 -178.156 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.54 -7.98 88.0 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.999 -0.619 . . . . 0.0 112.289 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.21 38.72 3.13 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.948 0.404 . . . . 0.0 110.133 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.5 tt -99.06 134.43 38.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.523 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -147.97 171.54 15.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.127 0.489 . . . . 0.0 111.585 -172.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.466 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 2.0 t -120.28 145.65 46.87 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.076 172.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -128.68 157.61 40.87 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -176.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.47 ' HB2' ' CD1' ' A' ' 81' ' ' LEU . 10.6 t-20 -151.26 160.42 43.82 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 -177.272 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.52 146.79 23.01 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.011 176.103 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.604 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 10.7 Cg_endo -54.08 -38.13 87.09 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.154 2.569 . . . . 0.0 112.976 -176.198 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.5 -13.97 62.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.966 0.413 . . . . 0.0 111.717 -175.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -103.39 -50.11 3.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.638 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 22.7 m -59.76 -36.83 77.46 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.795 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.604 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.9 m-80 -104.8 16.93 25.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.029 -176.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -56.03 -27.68 54.2 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.725 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.993 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 12.2 t70 -116.17 133.28 56.19 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 172.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 17.2 m -66.88 -21.21 66.01 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -176.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.1 tp -91.09 -25.3 19.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.245 0.545 . . . . 0.0 110.12 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.993 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 3.1 tp -61.57 -37.63 84.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.47 -177.005 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.623 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -64.64 -20.14 66.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.91 -177.084 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -95.96 -9.73 56.95 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.045 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.587 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 2.0 mp -85.82 -26.07 25.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.825 0.345 . . . . 0.0 111.154 -177.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.623 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.3 OUTLIER -80.03 -11.11 59.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.939 0.4 . . . . 0.0 111.744 -175.646 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.637 ' HA3' ' CB ' ' A' ' 56' ' ' LEU . . . -128.05 91.28 0.34 Allowed Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.808 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.412 ' H ' HD21 ' A' ' 72' ' ' LEU . . . -77.91 74.68 4.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.258 0.551 . . . . 0.0 110.648 -178.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 159.49 -69.53 0.25 Allowed Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.136 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.2 tp -136.54 -40.72 0.63 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.637 ' CB ' ' HA3' ' A' ' 52' ' ' GLY . 0.1 OUTLIER 69.13 134.34 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 122.435 1.112 . . . . 0.0 112.672 178.603 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.565 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 8.8 t-20 -141.44 -178.8 5.79 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 114.202 -1.363 . . . . 0.0 107.9 171.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.692 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -114.97 -145.44 8.71 Favored Glycine 0 C--N 1.312 -0.768 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.62 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.468 ' HB3' ' HB2' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -65.2 156.28 32.33 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.469 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.7 m -52.28 101.94 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.099 0.476 . . . . 0.0 111.726 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 74.67 18.63 80.04 Favored Glycine 0 C--N 1.338 0.663 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.529 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.468 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 4.1 t30 -123.29 94.52 4.28 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.866 0.365 . . . . 0.0 110.795 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.06 99.67 7.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.065 0.459 . . . . 0.0 111.051 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 155.7 -55.37 0.41 Allowed Glycine 0 CA--C 1.508 -0.348 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 177.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.78 84.15 6.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.954 0.407 . . . . 0.0 109.999 175.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.692 ' HA ' ' HA2' ' A' ' 58' ' ' GLY . . . -90.54 150.81 21.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.936 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 m -124.26 136.34 54.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.972 0.415 . . . . 0.0 111.195 -174.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -105.63 139.23 40.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.95 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -95.54 168.24 10.81 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.732 -173.885 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.49 -33.32 73.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.047 0.451 . . . . 0.0 111.026 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -31.01 71.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.331 0.586 . . . . 0.0 110.173 177.313 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.458 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.0 OUTLIER -79.73 -21.65 44.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.686 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.94 -41.5 89.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.368 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -90.22 -0.44 57.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.461 . . . . 0.0 110.746 179.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -94.79 -52.95 4.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.535 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.587 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 1.1 mm? -118.67 -46.22 2.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.131 -177.082 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 101.97 52.54 1.01 Allowed Glycine 0 CA--C 1.519 0.315 0 C-N-CA 119.724 -1.227 . . . . 0.0 113.388 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.491 ' HG ' ' HB3' ' A' ' 51' ' ' LEU . 3.9 mm? -64.48 92.34 0.09 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.989 0.424 . . . . 0.0 111.736 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.8 -11.65 60.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.686 -178.564 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.24 -15.46 46.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.174 0.511 . . . . 0.0 110.621 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.47 ' CD1' ' HB2' ' A' ' 36' ' ' ASN . 0.0 OUTLIER -108.37 -16.35 14.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.622 -176.258 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.33 137.85 46.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.187 0.518 . . . . 0.0 110.976 -178.037 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.636 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 3.2 t70 -113.85 176.91 4.83 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 176.093 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -135.19 124.7 24.99 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -171.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.526 HG21 ' HD3' ' A' ' 116' ' ' LYS . 0.6 OUTLIER -117.15 -169.34 1.63 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.988 -1.006 . . . . 0.0 108.962 171.578 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.02 -29.15 61.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.849 0.357 . . . . 0.0 110.778 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.558 ' HB3' ' O ' ' A' ' 15' ' ' SER . 35.3 mp0 -76.6 -14.52 59.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.621 -178.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 135.51 -165.52 24.73 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 119.964 -1.113 . . . . 0.0 112.728 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -74.49 125.6 9.71 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.88 2.386 . . . . 0.0 111.802 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.521 HG11 ' HB3' ' A' ' 116' ' ' LYS . 0.7 OUTLIER -124.15 -177.96 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.079 -176.699 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.62 ' O ' ' HA ' ' A' ' 115' ' ' THR . 0.1 OUTLIER -70.28 129.93 40.65 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 178.495 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.636 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 11.8 tttp -79.74 -27.69 40.54 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.639 -176.286 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -155.02 -90.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -172.28 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.415 HD12 ' HA ' ' A' ' 36' ' ' ASN . 5.2 mt -95.63 138.66 20.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.002 -171.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.6 t -101.67 123.09 54.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.586 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.15 157.92 43.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.909 -177.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.36 124.26 49.25 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 177.507 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.442 ' CA ' ' HB3' ' A' ' 105' ' ' CYS . 8.3 t -135.45 133.03 20.12 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.188 -171.172 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.409 ' O ' ' HD2' ' A' ' 69' ' ' LYS . 36.9 Cg_endo -65.84 171.77 9.35 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.755 2.304 . . . . 0.0 111.683 174.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.63 -82.49 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -171.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -128.02 0.76 6.67 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.064 -1.065 . . . . 0.0 113.413 -174.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.03 142.32 51.57 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.682 0.241 . . . . 0.0 111.511 -175.006 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 6.3 m 73.59 157.32 0.19 Allowed 'General case' 0 CA--C 1.532 0.286 0 O-C-N 123.882 0.739 . . . . 0.0 112.304 175.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.565 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.7 OUTLIER -73.11 168.9 18.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.762 -175.374 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.442 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -113.22 141.82 46.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.027 -179.403 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -83.3 145.99 7.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.065 174.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.94 115.69 23.02 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.458 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -85.89 -8.63 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-O 121.837 0.827 . . . . 0.0 110.071 177.563 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -117.79 135.9 53.76 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 114.315 -1.311 . . . . 0.0 108.512 176.134 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -121.12 61.9 0.9 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.177 0.513 . . . . 0.0 109.877 -177.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 67.31 47.57 1.28 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.171 178.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -139.36 10.8 3.25 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.626 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -94.82 -154.91 0.44 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 122.758 -0.26 . . . . 0.0 110.836 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -158.56 -174.72 28.64 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 121.201 -0.523 . . . . 0.0 112.003 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.62 ' HA ' ' O ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -59.52 -63.53 1.27 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.167 0.508 . . . . 0.0 111.026 -178.709 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.542 ' HA ' ' OE1' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -152.7 146.9 25.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.343 178.691 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -80.44 127.58 32.58 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.7 177.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 C--O 1.248 1.019 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.855 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.477 0.913 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -102.23 115.21 64.9 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.554 179.116 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -68.81 156.71 64.56 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.996 2.464 . . . . 0.0 112.416 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 74.36 -20.19 0.33 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.588 0.755 . . . . 0.0 112.176 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.31 20.15 3.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.838 -0.164 . . . . 0.0 111.117 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 53.54 79.09 0.13 Allowed 'General case' 0 C--O 1.234 0.277 0 O-C-N 123.581 0.55 . . . . 0.0 111.64 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.91 73.22 7.45 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.096 -177.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.3 94.15 7.29 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.952 177.258 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -85.22 -30.29 23.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.718 -175.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.05 164.94 21.05 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.2 0.524 . . . . 0.0 112.103 -172.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.6 mttp -130.8 -69.66 0.64 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.523 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.96 -39.79 0.42 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.772 0.829 . . . . 0.0 111.612 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.3 -34.86 78.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.709 0.29 . . . . 0.0 111.39 179.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.71 -20.15 47.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.81 0.338 . . . . 0.0 111.641 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.684 ' HA ' ' O ' ' A' ' 87' ' ' GLU . 0.3 OUTLIER -76.19 68.15 2.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.211 0.529 . . . . 0.0 111.317 179.295 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.75 -19.9 66.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.851 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.5 ' HB1' ' HB3' ' A' ' 116' ' ' LYS . . . -82.04 -26.89 33.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.503 177.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.553 ' O ' ' HB2' ' A' ' 21' ' ' GLN . 41.2 t80 -82.73 -41.55 19.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.758 -178.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.76 -18.91 61.66 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.7 mttp -67.33 -18.01 64.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.014 0.435 . . . . 0.0 110.533 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.553 ' HB2' ' O ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -63.69 -28.1 69.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.562 177.927 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.05 -18.56 62.56 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.406 -178.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -98.35 -41.53 7.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.487 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -66.41 -30.33 76.39 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.679 177.122 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.601 HG21 HG21 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -133.62 123.02 24.32 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 176.241 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.79 97.64 1.82 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.02 0.438 . . . . 0.0 111.464 -176.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.465 ' HB2' HD12 ' A' ' 32' ' ' ILE . 79.8 m -139.51 -178.43 5.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.653 179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.701 ' H ' ' HB2' ' A' ' 31' ' ' SER . 30.0 t-20 -122.03 176.61 5.71 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 -176.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.43 HG23 ' H ' ' A' ' 30' ' ' GLY . 2.5 m -52.76 -53.49 20.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -178.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.43 ' H ' HG23 ' A' ' 29' ' ' VAL . . . -89.41 20.62 33.21 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.961 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.701 ' HB2' ' H ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -123.61 -12.2 7.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.849 0.357 . . . . 0.0 110.839 177.044 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.465 HD12 ' HB2' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -82.22 127.26 39.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 175.684 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.72 153.99 38.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.152 0.501 . . . . 0.0 111.462 -174.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.433 ' O ' HD13 ' A' ' 81' ' ' LEU . 11.5 t -122.7 143.06 50.04 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.628 176.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -127.54 163.83 23.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.605 0.716 . . . . 0.0 110.985 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.462 ' HB2' ' HA ' ' A' ' 81' ' ' LEU . 20.2 t-20 -136.14 160.82 37.51 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.19 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -45.8 137.07 5.99 Favored Pre-proline 0 C--N 1.329 -0.292 0 O-C-N 123.588 0.555 . . . . 0.0 110.457 177.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.496 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 79.7 Cg_exo -48.54 -36.84 32.58 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 123.254 2.636 . . . . 0.0 113.351 -175.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.02 -7.82 50.99 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -177.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.4 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 0.9 OUTLIER -109.18 -41.78 4.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.127 0.489 . . . . 0.0 109.86 178.551 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.437 HG21 ' HB3' ' A' ' 66' ' ' ALA . 29.0 m -65.45 -37.05 85.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.671 175.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.496 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.3 m-80 -100.27 15.31 28.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.707 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.4 ' HB2' ' HA ' ' A' ' 40' ' ' GLU . 10.1 t-20 -65.11 -32.75 74.61 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.474 -176.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.931 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.6 t70 -104.8 146.6 28.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.636 178.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.86 -36.94 75.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.002 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.3 tp -86.47 -20.89 27.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.134 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.931 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -53.73 -47.54 70.49 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.109 0.481 . . . . 0.0 111.203 179.047 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.59 -18.24 65.26 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.22 -178.304 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -93.98 -29.13 10.04 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.737 176.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.457 HD22 ' HG ' ' A' ' 76' ' ' LEU . 27.9 mt -74.11 -24.53 59.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 176.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.444 ' HA ' HD13 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -55.67 -51.8 66.02 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.691 173.219 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -87.02 74.23 2.35 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.842 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -100.9 32.92 2.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.593 0.711 . . . . 0.0 109.334 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 160.73 -111.88 0.5 Allowed Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.51 -174.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.567 HD12 ' HA2' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -117.15 72.33 0.83 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.364 0.602 . . . . 0.0 110.392 176.896 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.66 ' HG ' ' HZ2' ' A' ' 69' ' ' LYS . 1.5 mp -123.44 134.1 53.98 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.253 178.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -128.42 -177.34 4.13 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.297 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.72 -162.83 35.06 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.617 -0.802 . . . . 0.0 113.073 -173.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.402 HD23 ' HB2' ' A' ' 65' ' ' SER . 0.4 OUTLIER -65.35 158.2 27.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.508 0.194 . . . . 0.0 110.494 -179.679 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.968 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -61.07 88.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.464 0.65 . . . . 0.0 112.283 -177.638 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.03 4.1 78.76 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.454 -0.794 . . . . 0.0 113.11 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.4 t30 -117.66 134.6 54.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 117.123 0.461 . . . . 0.0 111.422 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.0 125.99 47.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.407 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.11 -49.37 0.93 Allowed Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.856 -0.687 . . . . 0.0 111.752 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.402 ' HB2' HD23 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -82.56 115.5 21.57 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 175.946 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.437 ' HB3' HG21 ' A' ' 41' ' ' THR . . . -127.77 147.34 50.41 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.265 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.9 m -121.08 135.63 55.15 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.909 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.806 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -105.82 152.45 23.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 176.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.66 ' HZ2' ' HG ' ' A' ' 56' ' ' LEU . 0.0 OUTLIER -111.62 -177.2 3.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.385 -176.956 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.3 -24.5 67.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.073 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -66.77 -31.02 71.38 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.417 0.627 . . . . 0.0 110.027 178.773 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.481 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -90.43 -33.72 15.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.709 179.632 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.1 mt -65.87 -39.45 84.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.597 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -84.48 -2.97 58.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.899 0.381 . . . . 0.0 110.841 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -94.75 -53.31 3.91 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.052 0.453 . . . . 0.0 110.823 178.38 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.468 ' HA ' HD13 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -126.28 -28.57 3.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.804 -175.339 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.04 50.69 4.49 Favored Glycine 0 C--O 1.228 -0.274 0 C-N-CA 120.343 -0.932 . . . . 0.0 111.929 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.6 mt -59.19 96.15 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.766 0.426 . . . . 0.0 111.944 -176.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.435 ' HG ' ' H ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -79.17 6.26 10.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.414 -177.15 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.97 -26.47 64.11 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.255 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.806 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -129.9 2.1 4.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.714 -176.292 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 39.0 t -111.69 138.25 41.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.12 0.486 . . . . 0.0 110.97 -175.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 3.3 t70 -123.87 177.31 5.81 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.427 176.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -136.2 137.74 41.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.048 0.451 . . . . 0.0 112.202 -172.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -135.56 -169.3 2.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.669 174.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -42.93 99.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.145 0.497 . . . . 0.0 109.968 177.67 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.684 ' O ' ' HA ' ' A' ' 15' ' ' SER . 3.1 mp0 -81.57 43.29 0.74 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.47 -179.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 80.89 -170.37 52.97 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.974 -0.557 . . . . 0.0 113.52 173.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.452 ' O ' ' HB3' ' A' ' 15' ' ' SER . 11.0 Cg_exo -70.84 134.5 25.84 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 123.072 2.514 . . . . 0.0 111.369 174.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.46 ' HB ' ' H ' ' A' ' 91' ' ' CYS . 0.6 OUTLIER -132.81 -153.6 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.66 -174.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.587 ' HB3' ' O ' ' A' ' 114' ' ' GLY . 0.5 OUTLIER -94.45 152.87 18.26 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.428 -178.036 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.433 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 1.1 tttt -92.92 -34.82 13.63 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.29 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -159.12 -62.4 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.416 HG23 ' HB3' ' A' ' 109' ' ' ASP . 33.3 mt -112.27 132.6 60.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.905 0.383 . . . . 0.0 111.809 -171.114 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.459 HG22 HG23 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -105.16 139.02 27.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.489 175.824 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.417 ' CB ' ' HA ' ' A' ' 107' ' ' ALA . . . -149.94 167.57 26.29 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 121.22 0.534 . . . . 0.0 111.859 -176.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 4.2 t -112.46 114.71 27.54 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.103 176.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.632 ' O ' ' HA ' ' A' ' 31' ' ' SER . 46.8 t -135.05 106.72 10.39 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.799 -174.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.665 ' HD2' HG21 ' A' ' 102' ' ' THR . 25.9 Cg_exo -67.54 144.83 68.34 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.958 2.439 . . . . 0.0 112.251 173.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.32 72.03 3.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.494 0.664 . . . . 0.0 109.802 171.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.567 ' HA2' HD12 ' A' ' 55' ' ' LEU . . . 145.11 63.46 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.313 -177.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.665 HG21 ' HD2' ' A' ' 99' ' ' PRO . 12.0 t -148.29 156.69 42.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.943 0.401 . . . . 0.0 111.061 -176.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -38.54 87.18 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.521 177.367 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.968 ' HB2' ' HA ' ' A' ' 60' ' ' SER . 0.2 OUTLIER -155.14 159.49 40.22 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.735 176.589 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.461 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 1.8 m -111.63 140.39 46.28 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 176.659 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -96.74 136.81 26.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.235 0.541 . . . . 0.0 111.477 -175.131 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.417 ' HA ' ' CB ' ' A' ' 96' ' ' ALA . . . -90.83 130.04 36.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.924 176.533 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.601 HG21 HG21 ' A' ' 25' ' ' THR . 0.0 OUTLIER -95.22 -6.26 10.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.423 0.63 . . . . 0.0 111.013 -179.004 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.416 ' HB3' HG23 ' A' ' 94' ' ' ILE . 2.7 t70 -72.65 129.06 37.38 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.389 175.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -132.09 17.86 4.56 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.669 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -144.01 -27.18 0.53 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -176.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 98.63 45.72 2.25 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.156 -175.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -143.44 120.02 11.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.807 0.337 . . . . 0.0 110.62 -177.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLY . . . . . 0.587 ' O ' ' HB3' ' A' ' 91' ' ' CYS . . . -177.93 66.82 0.08 OUTLIER Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.53 -0.843 . . . . 0.0 112.444 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.58 -60.12 2.48 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.622 0.725 . . . . 0.0 109.575 174.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.5 ' HB3' ' HB1' ' A' ' 17' ' ' ALA . 13.7 mtmt -128.8 -120.99 0.23 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 174.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -120.92 135.71 55.13 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 171.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 . . . . . 0 C--O 1.252 1.211 0 CA-C-O 118.598 -0.715 . . . . 0.0 109.714 178.015 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.612 HD13 ' HD2' ' A' ' 3' ' ' PRO . 0.8 OUTLIER -56.62 135.5 77.73 Favored Pre-proline 0 CA--C 1.533 0.294 0 O-C-N 123.342 0.401 . . . . 0.0 111.051 178.185 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.612 ' HD2' HD13 ' A' ' 2' ' ' LEU . 32.3 Cg_exo -59.77 99.48 0.13 Allowed 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 123.174 2.582 . . . . 0.0 112.921 -179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -162.7 157.21 21.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.332 177.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.22 -1.79 34.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.187 0.517 . . . . 0.0 110.798 179.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -100.39 40.33 1.27 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.191 -177.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -87.52 59.57 5.55 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.16 0.505 . . . . 0.0 110.496 178.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.0 mtpt -129.52 4.34 5.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.132 -177.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.3 p-10 -127.62 24.31 6.18 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.239 0.542 . . . . 0.0 110.501 -179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -90.09 143.04 27.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.519 -178.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.7 mmtt -95.6 157.24 15.98 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.34 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.445 ' HB2' ' HB3' ' A' ' 15' ' ' SER . 5.2 mp -79.21 61.34 3.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.983 -177.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 36.82 74.05 0.08 Allowed 'General case' 0 N--CA 1.472 0.636 0 O-C-N 124.144 0.903 . . . . 0.0 112.986 175.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.27 62.71 1.14 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.602 0.715 . . . . 0.0 111.083 -177.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.445 ' HB3' ' HB2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -85.25 49.69 1.8 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.135 -177.316 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.413 ' HB3' ' OE1' ' A' ' 87' ' ' GLU . . . -67.67 -51.44 49.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.907 ' HB1' ' HE3' ' A' ' 116' ' ' LYS . . . -59.49 -33.08 70.89 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.479 176.101 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.606 ' HB2' HG12 ' A' ' 90' ' ' VAL . 23.7 t80 -70.25 -47.1 62.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.056 0.455 . . . . 0.0 110.335 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.8 -23.98 64.35 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.915 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -67.9 -25.08 65.31 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.847 0.832 . . . . 0.0 109.254 177.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -93.11 -38.16 11.75 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.409 -1.268 . . . . 0.0 110.601 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.73 -17.81 64.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.97 -176.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.62 -8.02 57.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.939 0.399 . . . . 0.0 110.677 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.31 1.72 37.45 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.802 -0.714 . . . . 0.0 111.44 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.433 HG21 ' HB ' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -114.65 124.55 52.12 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.297 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.43 94.59 2.1 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.08 0.467 . . . . 0.0 111.06 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 27.7 m -151.85 -177.53 6.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.036 179.052 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -112.7 151.32 30.36 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 176.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.9 t -58.29 -40.89 79.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.917 0.389 . . . . 0.0 111.066 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.51 8.33 54.58 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.486 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -143.58 32.46 1.3 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.944 0.402 . . . . 0.0 110.312 178.152 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.9 134.86 31.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.503 ' CB ' ' HB3' ' A' ' 98' ' ' CYS . . . -149.2 170.88 17.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.254 0.549 . . . . 0.0 111.974 -175.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.2 t -118.26 141.87 48.07 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.829 173.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -126.17 156.29 40.39 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.398 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.456 ' HA ' HD12 ' A' ' 94' ' ' ILE . 56.0 t30 -156.2 160.37 39.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.172 178.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.597 ' HB2' ' OE1' ' A' ' 40' ' ' GLU . 1.5 m -59.61 148.45 74.64 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.069 -177.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.63 ' HA ' HG22 ' A' ' 41' ' ' THR . 32.4 Cg_endo -65.79 -26.72 52.37 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.031 2.488 . . . . 0.0 113.424 -175.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.23 -11.92 58.71 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.142 0.496 . . . . 0.0 111.312 -176.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.597 ' OE1' ' HB2' ' A' ' 37' ' ' SER . 1.9 mp0 -108.17 -51.03 2.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.229 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.63 HG22 ' HA ' ' A' ' 38' ' ' PRO . 1.2 t -69.63 -20.56 63.6 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.296 -176.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.582 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.5 m120 -105.47 3.46 29.55 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 -178.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -71.76 -46.92 56.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.741 0.305 . . . . 0.0 111.386 -176.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 1.046 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 61.1 t0 -75.68 133.6 40.77 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 178.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -23.61 66.94 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.633 178.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.608 ' HG ' HD13 ' A' ' 50' ' ' LEU . 11.3 tp -87.14 -32.6 19.79 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.288 177.298 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 1.046 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -64.52 -34.22 77.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.145 -177.185 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -18.12 64.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.074 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -102.73 -30.44 5.52 Favored Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 111.374 -0.69 . . . . 0.0 111.374 173.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.67 ' HG ' ' HB3' ' A' ' 76' ' ' LEU . 1.9 mp -60.28 -36.45 77.85 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 122.667 0.387 . . . . 0.0 110.992 178.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.8 pp -73.4 -11.25 60.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.005 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.61 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -111.99 66.31 0.24 Allowed Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.227 -178.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.442 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -78.87 66.7 4.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.907 0.384 . . . . 0.0 111.4 -178.339 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 90.43 82.92 1.38 Allowed Glycine 0 C--O 1.226 -0.356 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.04 176.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.5 tp 63.27 20.57 12.35 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.857 0.463 . . . . 0.0 112.029 176.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.789 HD22 ' HA2' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -53.87 145.84 15.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.816 178.089 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -113.24 -178.23 3.33 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.452 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -109.03 -158.28 18.61 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.073 -176.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.74 HD23 ' HB3' ' A' ' 62' ' ' ASN . 1.2 tp -77.5 138.42 39.2 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 120.737 0.303 . . . . 0.0 110.216 178.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.6 m -53.34 108.05 0.3 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.444 -175.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.11 -12.87 64.9 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.549 173.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.74 ' HB3' HD23 ' A' ' 59' ' ' LEU . 18.8 t30 -127.92 114.57 17.34 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.321 0.581 . . . . 0.0 110.954 -178.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.11 160.08 30.11 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.919 -178.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.419 ' C ' ' HB3' ' A' ' 38' ' ' PRO . . . 94.92 -42.45 2.39 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.617 178.1 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.446 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 0.7 OUTLIER -81.98 117.62 22.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.874 0.369 . . . . 0.0 110.48 -178.761 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.16 143.86 34.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.08 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.68 128.69 55.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.028 0.442 . . . . 0.0 110.858 -178.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.529 ' HB2' HD12 ' A' ' 81' ' ' LEU . . . -112.78 129.83 56.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.95 -177.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.774 ' HZ1' HD11 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -95.94 173.27 7.53 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.539 -178.943 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.444 ' HA ' HD13 ' A' ' 73' ' ' ILE . . . -58.24 -29.94 66.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.911 0.386 . . . . 0.0 111.207 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -28.3 68.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.096 178.222 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.657 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 2.0 mp -86.37 -17.71 33.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.061 0.458 . . . . 0.0 110.586 -179.031 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.453 HG13 HG21 ' A' ' 82' ' ' VAL . 0.5 OUTLIER -63.59 -41.53 92.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.969 177.901 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -89.52 -12.83 38.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.271 0.558 . . . . 0.0 110.564 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.657 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.5 OUTLIER -77.04 -53.53 7.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.222 -178.344 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.67 ' HB3' ' HG ' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -125.5 -29.99 3.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.312 -175.824 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.31 48.69 18.1 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 120.302 -0.951 . . . . 0.0 111.999 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.412 ' H ' HD12 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -74.95 97.29 3.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.833 0.349 . . . . 0.0 111.129 -177.716 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.34 8.46 2.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.366 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.28 -27.28 47.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.019 0.438 . . . . 0.0 109.935 174.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.529 HD12 ' HB2' ' A' ' 68' ' ' ALA . 7.9 mt -117.83 -5.62 11.06 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.597 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.453 HG21 HG13 ' A' ' 73' ' ' ILE . 11.6 t -117.46 138.0 49.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.481 178.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -132.49 178.06 7.12 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.079 178.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -136.03 98.89 3.99 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.842 0.353 . . . . 0.0 111.205 -174.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.5 t -82.3 -173.6 4.65 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.866 175.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -78.72 55.36 1.67 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.076 0.465 . . . . 0.0 110.808 -178.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.413 ' OE1' ' HB3' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -161.11 -59.88 0.05 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.854 -178.996 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -171.82 -174.48 39.39 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.811 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.09 121.3 7.92 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.755 2.303 . . . . 0.0 110.76 174.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.606 HG12 ' HB2' ' A' ' 18' ' ' PHE . 2.7 m -136.28 -174.31 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.211 0.529 . . . . 0.0 111.619 -170.208 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.49 130.62 43.62 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.902 177.377 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.1 tttt -71.91 -43.91 64.56 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.012 0.434 . . . . 0.0 110.311 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -149.56 -100.92 0.07 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.257 -173.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.456 HD12 ' HA ' ' A' ' 36' ' ' ASN . 6.7 mt -73.61 126.88 35.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.765 -169.17 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.433 ' HB ' HG21 ' A' ' 25' ' ' THR . 0.1 OUTLIER -89.57 133.14 32.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.242 177.879 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.463 ' HB1' ' O ' ' A' ' 106' ' ' VAL . . . -153.5 167.53 29.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.139 0.495 . . . . 0.0 111.83 -175.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -109.26 132.75 53.82 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 174.741 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.517 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 44.0 t -152.45 135.0 8.99 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-O 120.81 0.338 . . . . 0.0 111.636 -171.081 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.413 ' O ' ' HD2' ' A' ' 69' ' ' LYS . 75.2 Cg_endo -77.29 -177.84 4.14 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 123.411 2.741 . . . . 0.0 111.019 172.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -76.28 -121.59 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -176.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.789 ' HA2' HD22 ' A' ' 56' ' ' LEU . . . -92.52 51.7 2.69 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 121.074 -0.584 . . . . 0.0 112.983 -176.23 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.35 137.23 1.08 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 176.57 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.2 m 72.85 147.69 0.09 Allowed 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.24 0.962 . . . . 0.0 111.653 178.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.09 164.11 27.17 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.857 -177.522 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.517 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.8 OUTLIER -111.12 143.17 42.27 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.696 -179.966 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.463 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 0.9 OUTLIER -100.69 138.7 24.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.057 0.456 . . . . 0.0 110.435 -177.693 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.98 122.93 41.7 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.935 178.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -98.23 14.2 4.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.265 0.555 . . . . 0.0 111.051 -177.288 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -123.54 120.93 34.31 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.893 174.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -142.79 4.57 1.5 Allowed 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.587 176.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -178.62 23.73 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.665 -175.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -110.28 -12.16 18.22 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.765 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . 68.76 57.87 0.4 Allowed 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.164 0.585 . . . . 0.0 111.45 175.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -72.84 116.44 5.64 Favored Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.744 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 33.1 m -160.1 101.28 1.41 Allowed 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.907 ' HE3' ' HB1' ' A' ' 17' ' ' ALA . 0.0 OUTLIER -98.37 2.2 47.71 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.835 179.624 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ALA . . . . . 0.676 ' O ' ' HB2' ' A' ' 118' ' ' GLU . . . -82.64 73.89 9.65 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 172.082 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.676 ' HB2' ' O ' ' A' ' 117' ' ' ALA . 0.6 OUTLIER . . . . . 0 C--O 1.255 1.346 0 CA-C-N 113.833 -1.53 . . . . 0.0 107.569 -171.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.453 ' HB2' ' H ' ' A' ' 2' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.571 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.482 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 9.9 mt -119.82 133.04 23.86 Favored Pre-proline 0 C--N 1.328 -0.336 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 177.486 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 2' ' ' LEU . 12.1 Cg_exo -69.9 167.29 25.04 Favored 'Trans proline' 0 C--O 1.234 0.279 0 C-N-CA 123.14 2.56 . . . . 0.0 112.618 -178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.62 -158.25 0.64 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.287 178.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.15 -61.59 1.54 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.92 0.39 . . . . 0.0 110.891 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.67 57.86 3.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.732 -175.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -118.81 81.45 1.7 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.11 178.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -152.11 36.59 0.54 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.747 -175.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -84.35 42.86 0.91 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.325 -177.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -123.68 134.8 53.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.461 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.2 mttm -138.26 -67.55 0.47 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.484 -179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.401 HD22 ' HA ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER 74.89 -52.1 0.67 Allowed 'General case' 0 N--CA 1.469 0.475 0 O-C-N 123.911 0.757 . . . . 0.0 111.799 176.701 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.84 -33.74 76.35 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.091 0.472 . . . . 0.0 111.016 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -4.7 57.45 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.659 -179.21 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.507 ' HA ' ' HA3' ' A' ' 88' ' ' GLY . 4.1 m -83.26 92.22 7.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.185 -178.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.1 -31.46 67.81 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.33 0.586 . . . . 0.0 109.652 176.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.96 -31.81 72.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.185 176.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.567 ' HD1' ' HA ' ' A' ' 90' ' ' VAL . 22.8 t80 -73.23 -35.0 66.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.246 0.546 . . . . 0.0 109.836 176.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.63 -29.57 68.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.173 0.511 . . . . 0.0 110.463 174.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.1 tttt -66.74 -38.41 86.59 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 174.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.412 ' HG2' HG11 ' A' ' 95' ' ' VAL . 0.8 OUTLIER -61.55 -35.08 76.75 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.849 176.468 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.58 -11.59 60.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.53 -178.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.14 -35.04 6.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.137 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.15 -34.37 89.49 Favored Glycine 0 N--CA 1.451 -0.366 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 175.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.22 129.9 55.76 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 174.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.9 m -68.83 98.23 0.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -170.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 98.7 m -144.65 -178.16 5.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.031 -0.986 . . . . 0.0 108.595 174.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -101.17 150.41 22.97 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.191 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.5 -31.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.783 -177.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.5 -49.41 5.82 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.545 -0.836 . . . . 0.0 111.023 175.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.443 ' HB3' ' HA ' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -87.56 53.69 2.88 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.345 -0.428 . . . . 0.0 110.738 179.034 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.441 HD12 ' HA ' ' A' ' 32' ' ' ILE . 9.0 tp -108.68 139.52 30.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.936 0.398 . . . . 0.0 110.694 -179.343 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.777 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . . . -150.21 -178.74 6.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.348 0.594 . . . . 0.0 112.003 -177.313 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 48.8 t -133.16 134.41 44.1 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 171.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.447 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 99.3 m -106.53 145.08 32.3 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.018 0.437 . . . . 0.0 110.232 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -139.21 150.87 46.04 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.598 ' HB2' ' OE1' ' A' ' 40' ' ' GLU . 0.3 OUTLIER -42.71 139.08 2.11 Favored Pre-proline 0 CA--C 1.536 0.418 0 O-C-N 123.877 0.736 . . . . 0.0 112.434 179.807 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.461 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 20.3 Cg_endo -59.86 -40.61 61.43 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.561 2.841 . . . . 0.0 114.038 -171.36 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.76 -19.96 65.17 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.22 0.533 . . . . 0.0 111.661 -174.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.598 ' OE1' ' HB2' ' A' ' 37' ' ' SER . 45.3 mp0 -100.37 -39.83 7.79 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.064 -179.09 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 47.4 m -64.93 -35.49 81.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.641 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -104.04 15.7 27.94 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.862 -177.748 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -59.69 -25.59 64.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.986 -174.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 1.052 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 15.2 t70 -121.61 135.28 55.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.476 -177.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.77 -35.08 72.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.671 0.272 . . . . 0.0 111.315 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.424 ' HB3' ' OD2' ' A' ' 44' ' ' ASP . 2.6 tp -76.47 -40.52 50.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.99 0.424 . . . . 0.0 110.046 178.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 1.052 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 2.7 tp -56.74 -42.94 80.15 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.935 176.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.481 ' HA ' HD11 ' A' ' 51' ' ' LEU . 15.9 m -64.75 -9.14 18.07 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.176 -0.466 . . . . 0.0 112.213 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -108.95 -5.08 31.18 Favored Glycine 0 C--O 1.228 -0.235 0 N-CA-C 111.214 -0.754 . . . . 0.0 111.214 174.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.728 ' HG ' HD23 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -84.68 -25.81 28.19 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.546 -0.327 . . . . 0.0 111.287 -176.698 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.604 ' HG ' ' HB1' ' A' ' 66' ' ' ALA . 0.0 OUTLIER -77.4 1.23 19.64 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.448 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -146.52 85.81 0.17 Allowed Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.259 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.56 51.71 0.75 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.266 0.555 . . . . 0.0 110.872 178.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 171.11 -99.9 0.15 Allowed Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.42 ' O ' HG22 ' A' ' 102' ' ' THR . 0.7 OUTLIER -149.21 48.03 0.98 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.63 0.729 . . . . 0.0 109.621 176.159 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.691 HD13 ' HE3' ' A' ' 69' ' ' LYS . 0.2 OUTLIER -87.92 -178.89 6.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.139 -176.842 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.447 ' H ' HD23 ' A' ' 56' ' ' LEU . 1.1 t-20 -140.94 -176.37 4.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.033 -175.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.561 ' HA3' ' HA ' ' A' ' 66' ' ' ALA . . . -113.55 -118.66 3.46 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.289 -175.382 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.426 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -65.45 140.22 58.59 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.62 0.247 . . . . 0.0 110.338 179.409 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.566 ' HA ' ' CB ' ' A' ' 104' ' ' ASN . 64.2 m -62.85 89.89 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.368 -178.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.67 -36.42 4.26 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.947 -0.644 . . . . 0.0 112.738 177.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -91.08 101.98 14.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.026 0.441 . . . . 0.0 111.214 -176.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.72 93.54 3.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.993 179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 170.58 -54.28 0.19 Allowed Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.279 -0.729 . . . . 0.0 111.279 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.49 106.72 8.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 174.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.604 ' HB1' ' HG ' ' A' ' 51' ' ' LEU . . . -107.09 154.87 20.52 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.091 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.58 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 4.9 m -135.46 145.69 47.43 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -177.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 1.025 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -105.23 130.45 53.37 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.126 0.488 . . . . 0.0 110.454 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 1.047 ' HD3' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -84.3 161.78 20.32 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.585 -178.757 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.662 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -56.78 -36.3 69.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.743 0.306 . . . . 0.0 111.638 -178.106 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -64.86 -31.05 72.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.486 0.66 . . . . 0.0 110.123 178.38 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.506 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -79.67 -33.51 41.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.564 179.255 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.662 HD12 ' HA ' ' A' ' 70' ' ' ALA . 41.0 mt -66.49 -34.49 70.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.558 177.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -73.5 -40.2 64.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.688 175.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.405 ' HB2' ' O ' ' A' ' 71' ' ' SER . 0.9 OUTLIER -76.54 -55.09 5.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -174.777 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.728 HD23 ' HG ' ' A' ' 50' ' ' LEU . 3.7 mp -109.85 -28.33 8.83 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.915 -0.314 . . . . 0.0 111.133 -173.169 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.402 ' HA2' ' O ' ' A' ' 73' ' ' ILE . . . 82.61 50.43 4.72 Favored Glycine 0 CA--C 1.516 0.15 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.526 173.067 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.538 ' HG ' HD23 ' A' ' 50' ' ' LEU . 4.7 mp -68.04 108.3 3.03 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.108 0.48 . . . . 0.0 111.546 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.511 ' HG ' ' H ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -90.69 12.06 20.24 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.887 178.995 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.04 -26.46 60.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.51 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 1.025 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -119.42 9.75 11.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.52 -175.627 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.4 t -104.62 136.56 37.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.757 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 28.3 t0 -117.13 168.99 9.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.072 0.463 . . . . 0.0 111.746 -176.313 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.8 p-80 -56.96 147.47 23.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.405 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.455 HG21 ' C ' ' A' ' 88' ' ' GLY . 9.5 t -153.96 155.72 36.13 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.118 0.485 . . . . 0.0 111.752 -175.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.13 -0.55 15.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.554 0.692 . . . . 0.0 109.44 174.146 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.439 ' HB3' ' H ' ' A' ' 88' ' ' GLY . 7.6 tm-20 -115.0 -86.33 0.6 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.389 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.507 ' HA3' ' HA ' ' A' ' 15' ' ' SER . . . -141.89 155.04 25.23 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 172.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.407 ' N ' HG21 ' A' ' 85' ' ' THR . 82.2 Cg_exo -45.32 119.53 2.63 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.185 2.59 . . . . 0.0 112.094 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.567 ' HA ' ' HD1' ' A' ' 18' ' ' PHE . 1.6 m -120.04 179.85 1.95 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.722 -172.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 5.2 t -67.36 130.69 43.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.626 178.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.757 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttp -77.81 -30.43 51.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.578 -177.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -149.09 -89.07 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -171.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 4.9 mt -95.97 122.43 47.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.51 -169.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.428 HG23 ' HB3' ' A' ' 109' ' ' ASP . 0.0 OUTLIER -83.36 128.88 38.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.706 179.329 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.447 ' HB3' ' SG ' ' A' ' 35' ' ' CYS . . . -154.5 170.36 21.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.601 -178.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -115.31 124.0 50.17 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.978 0.418 . . . . 0.0 110.97 179.825 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 1.047 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 3.2 m -114.65 119.56 39.37 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.936 -178.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.473 ' O ' HD21 ' A' ' 56' ' ' LEU . 68.6 Cg_endo -75.5 139.74 23.36 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.327 2.018 . . . . 0.0 111.672 174.091 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.29 140.86 40.14 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 174.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 118.15 -91.99 0.53 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.634 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.42 HG22 ' O ' ' A' ' 55' ' ' LEU . 0.3 OUTLIER -141.17 179.32 6.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.674 0.273 . . . . 0.0 111.134 -175.261 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.494 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.2 OUTLIER 65.67 -167.59 0.21 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.383 -0.826 . . . . 0.0 113.045 174.455 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.566 ' CB ' ' HA ' ' A' ' 60' ' ' SER . 80.4 m-20 -98.03 173.3 7.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.656 0.741 . . . . 0.0 112.67 -162.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 29.2 m -112.28 141.71 45.66 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.1 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.4 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 0.9 OUTLIER -95.58 143.57 11.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 120.821 0.343 . . . . 0.0 110.344 178.369 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -105.34 115.29 30.01 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 8.9 p -91.24 0.53 8.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.753 0.787 . . . . 0.0 111.37 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.428 ' HB3' HG23 ' A' ' 95' ' ' VAL . 28.9 t0 -148.63 146.83 28.38 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.857 175.14 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -121.54 13.24 10.89 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.382 -177.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -116.55 -62.93 1.52 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -177.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 83.73 74.2 1.23 Allowed Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 -172.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -78.01 88.85 4.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.942 0.401 . . . . 0.0 111.482 -175.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 89.65 -159.23 28.02 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.576 176.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 3.6 p -103.36 -79.43 0.54 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.332 0.587 . . . . 0.0 110.485 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.509 ' HG2' HG21 ' A' ' 90' ' ' VAL . 0.2 OUTLIER -150.88 20.9 0.79 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.885 177.307 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -110.49 117.35 33.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.47 -175.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.008 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.415 176.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.477 0.916 0 CA-C-O 120.601 0.239 . . . . 0.0 110.661 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.483 HD22 ' HA ' ' A' ' 2' ' ' LEU . 0.2 OUTLIER -178.33 115.62 0.24 Allowed Pre-proline 0 C--O 1.234 0.287 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.582 179.886 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.46 88.57 0.41 Allowed 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 123.164 2.576 . . . . 0.0 112.416 179.181 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -95.26 168.2 10.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.33 177.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.43 158.65 31.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.91 178.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 66.72 68.91 0.42 Allowed 'General case' 0 N--CA 1.463 0.199 0 O-C-N 123.813 0.696 . . . . 0.0 111.228 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -140.91 145.19 35.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.896 178.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -99.49 74.97 1.93 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.291 0.567 . . . . 0.0 110.407 -177.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -133.61 114.04 13.07 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.174 0.512 . . . . 0.0 111.375 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.76 133.66 3.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.794 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.811 ' HB3' ' HB2' ' A' ' 15' ' ' SER . 1.1 mtmt -126.07 144.29 50.78 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.416 -179.343 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.71 ' HG ' ' OG ' ' A' ' 15' ' ' SER . 0.1 OUTLIER -81.0 74.88 7.99 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 177.081 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 72.35 -31.0 0.22 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.771 0.829 . . . . 0.0 111.634 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.447 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -149.12 -68.56 0.21 Allowed 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.753 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.811 ' HB2' ' HB3' ' A' ' 11' ' ' LYS . 2.3 m 67.3 -67.95 0.16 Allowed 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.427 0.691 . . . . 0.0 112.555 176.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.771 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . 56.8 -87.39 0.02 OUTLIER 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.421 0.688 . . . . 0.0 111.21 -175.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.458 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . . . -71.24 -35.77 71.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.876 0.37 . . . . 0.0 110.614 -179.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.497 ' HB2' HG12 ' A' ' 90' ' ' VAL . 19.9 t80 -70.52 -16.71 62.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.618 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.75 -15.45 59.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.963 0.411 . . . . 0.0 110.549 177.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.458 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 3.4 mttt -83.26 -24.35 32.31 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 175.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -32.45 72.91 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.241 176.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.27 -17.14 64.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.879 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -101.09 -50.54 3.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.602 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.83 -17.78 69.75 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.704 -178.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.5 m -119.67 134.94 55.02 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.36 97.49 9.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.964 0.412 . . . . 0.0 110.98 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -140.32 -178.19 5.37 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.419 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -120.91 172.2 8.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.568 0.223 . . . . 0.0 110.94 -175.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.408 HG13 ' N ' ' A' ' 30' ' ' GLY . 14.5 p -61.77 -45.58 98.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.76 -175.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.408 ' N ' HG13 ' A' ' 29' ' ' VAL . . . -100.62 20.01 50.04 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.771 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 1.2 m -125.98 -5.58 6.79 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.552 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -80.09 126.45 39.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.425 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.573 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -148.25 160.31 43.08 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.291 0.567 . . . . 0.0 111.966 -170.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 m -114.58 139.23 49.77 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.428 174.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.414 ' HB3' ' HB ' ' A' ' 94' ' ' ILE . 0.5 OUTLIER -124.62 160.16 29.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.838 0.351 . . . . 0.0 110.853 -176.591 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -145.74 160.03 42.31 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.758 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -51.4 150.69 6.12 Favored Pre-proline 0 CA--C 1.536 0.44 0 O-C-N 123.549 0.531 . . . . 0.0 111.321 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 47.2 Cg_exo -53.47 -49.02 18.82 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.082 2.521 . . . . 0.0 113.3 -171.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.06 -11.41 60.94 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -174.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' A' ' 43' ' ' ASN . 0.1 OUTLIER -103.27 -43.85 5.33 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.085 0.469 . . . . 0.0 110.035 179.881 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.826 HG21 ' H ' ' A' ' 66' ' ' ALA . 0.6 OUTLIER -65.84 -34.28 77.8 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.147 176.104 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.528 ' ND2' ' HB3' ' A' ' 48' ' ' SER . 1.8 m120 -104.16 14.69 29.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.312 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.429 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 4.5 t-20 -47.58 -38.7 14.95 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.537 -176.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.642 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 9.8 t70 -113.2 142.18 46.09 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.386 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.0 -35.21 74.54 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.231 0.332 . . . . 0.0 111.149 -179.38 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.37 -32.33 58.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.921 0.391 . . . . 0.0 109.954 178.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.642 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.6 OUTLIER -61.72 -39.36 91.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.522 -179.128 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.66 ' HA ' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -58.22 -31.38 67.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.478 179.505 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -84.13 -30.31 28.68 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.911 178.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.422 ' HG ' HD13 ' A' ' 76' ' ' LEU . 1.4 mp -69.28 -20.93 63.91 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.815 0.34 . . . . 0.0 111.096 -178.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.66 HD12 ' HA ' ' A' ' 48' ' ' SER . 3.3 mt -74.01 -14.1 60.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.532 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.666 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -126.97 76.42 0.4 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.599 -0.81 . . . . 0.0 111.621 -177.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.91 -20.35 33.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.969 0.414 . . . . 0.0 110.798 -176.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -139.01 68.23 0.5 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.509 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 mt 53.03 45.89 27.86 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.389 0.614 . . . . 0.0 111.112 177.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.666 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -84.73 161.19 20.11 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.351 -177.305 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.588 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 30.8 t-20 -126.08 -177.68 4.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.875 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -100.03 -152.77 26.9 Favored Glycine 0 C--O 1.225 -0.444 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.009 -176.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.818 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -70.35 146.37 50.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.979 0.419 . . . . 0.0 110.864 179.938 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.4 m -59.23 98.04 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.516 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.39 4.89 65.79 Favored Glycine 0 C--O 1.229 -0.203 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.424 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.818 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 1.6 t-20 -128.93 100.56 5.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.181 0.515 . . . . 0.0 110.796 -177.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.19 71.85 9.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.282 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -166.21 -61.71 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.981 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.71 113.44 18.9 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.023 0.439 . . . . 0.0 110.973 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.826 ' H ' HG21 ' A' ' 41' ' ' THR . . . -107.53 153.71 22.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.216 173.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.604 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 0.1 OUTLIER -126.53 141.04 52.0 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.538 -175.5 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.922 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -105.41 128.6 53.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.333 0.587 . . . . 0.0 110.043 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.65 ' HG2' ' HB2' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -76.83 170.17 16.96 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.724 -176.808 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.482 ' HB2' HD22 ' A' ' 12' ' ' LEU . . . -60.55 -27.74 67.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.879 0.371 . . . . 0.0 111.308 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.55 -31.11 63.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.945 0.879 . . . . 0.0 109.071 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.65 ' HB2' ' HG2' ' A' ' 69' ' ' LYS . 0.5 OUTLIER -80.96 -27.07 36.16 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.277 178.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 69' ' ' LYS . 23.8 mm -64.6 -42.77 96.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.724 176.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -20.57 63.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.385 177.065 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.474 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -70.38 -53.83 14.96 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.504 -177.075 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.422 HD13 ' HG ' ' A' ' 50' ' ' LEU . 0.7 OUTLIER -136.95 -5.92 1.89 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -171.894 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.44 51.92 7.01 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 119.799 -1.191 . . . . 0.0 112.12 -178.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.408 ' O ' HG23 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -62.36 83.68 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.968 0.413 . . . . 0.0 111.781 -176.962 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.416 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -71.91 4.85 3.01 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -175.191 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.63 -23.13 42.82 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -175.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.922 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -125.57 -4.47 7.16 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.22 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.509 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -115.94 138.22 47.09 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.525 0 CA-C-O 121.513 0.673 . . . . 0.0 111.789 -177.382 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.859 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 21.7 t70 -112.96 153.44 28.02 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.962 -1.017 . . . . 0.0 108.578 176.114 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -117.65 103.33 9.93 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.998 -174.24 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 78.3 p -104.75 -168.69 1.51 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.396 175.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.401 ' HG2' ' H ' ' A' ' 86' ' ' GLU . 0.4 OUTLIER -66.03 -25.32 67.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.771 0.32 . . . . 0.0 111.043 179.521 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.771 ' HB3' ' HB3' ' A' ' 16' ' ' ALA . 2.5 mp0 -71.54 -32.01 67.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.286 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 130.2 -146.1 17.2 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.481 -0.866 . . . . 0.0 111.794 -178.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -74.76 108.7 2.76 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.958 2.439 . . . . 0.0 111.346 175.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.497 HG12 ' HB2' ' A' ' 18' ' ' PHE . 0.6 OUTLIER -122.41 162.51 22.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.05 -179.231 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -67.27 124.17 22.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.941 0.401 . . . . 0.0 110.52 -177.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.859 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 2.4 tttp -70.83 -24.0 62.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.827 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.444 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -152.8 -95.18 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.14 -174.343 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.444 HG13 ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -92.81 136.77 23.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.597 -173.024 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -97.61 129.23 48.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 172.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -140.8 163.8 31.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.921 0.391 . . . . 0.0 111.363 -174.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.84 109.08 19.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.159 177.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.771 ' O ' ' HA ' ' A' ' 31' ' ' SER . 64.1 m -110.87 116.79 51.51 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.505 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.0 132.9 14.56 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.273 1.982 . . . . 0.0 111.934 177.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.12 120.18 23.28 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.086 176.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.5 ' O ' ' HB ' ' A' ' 102' ' ' THR . . . 137.87 -52.01 0.76 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.077 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.5 ' HB ' ' O ' ' A' ' 101' ' ' GLY . 5.1 t 176.33 177.52 0.24 Allowed 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.506 -0.183 . . . . 0.0 110.506 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 76.34 157.75 0.19 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.023 0.929 . . . . 0.0 112.517 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.588 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.3 OUTLIER -75.08 175.52 8.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.818 -175.023 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 10.9 m -112.11 141.9 45.22 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.884 -178.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.7 m -91.88 138.94 18.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.616 174.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.7 128.93 44.73 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -94.61 7.03 6.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.591 0.71 . . . . 0.0 110.781 -178.042 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -121.5 142.56 49.93 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.38 172.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -142.04 20.25 2.11 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.74 -178.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -135.46 -37.93 0.76 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.311 -177.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 86.05 55.09 2.58 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -176.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -112.46 179.07 4.09 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 110.545 -0.169 . . . . 0.0 110.545 -178.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -77.47 80.98 1.25 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.292 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.46 80.38 5.84 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.762 0.315 . . . . 0.0 110.915 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.61 30.0 0.07 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.149 176.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -121.47 143.77 49.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.688 -175.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.432 ' OXT' ' HG3' ' A' ' 118' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.021 -0.99 . . . . 0.0 108.999 177.525 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.477 0.899 0 CA-C-O 120.279 0.085 . . . . 0.0 110.804 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 65.44 91.05 0.08 OUTLIER Pre-proline 0 N--CA 1.466 0.343 0 C-N-CA 123.026 0.53 . . . . 0.0 111.597 176.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.29 64.39 7.14 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 123.009 2.473 . . . . 0.0 112.151 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -76.97 -70.69 0.45 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.573 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 p -124.68 -93.07 0.51 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.868 0.366 . . . . 0.0 110.689 176.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.48 -11.57 23.65 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.557 -177.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.86 54.96 9.66 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 123.62 0.575 . . . . 0.0 111.627 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.72 101.49 4.31 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.375 -178.226 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -145.89 -8.1 0.55 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.722 -177.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -118.66 140.45 49.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.006 0.431 . . . . 0.0 111.825 -172.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.47 -59.78 1.21 Allowed 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.794 174.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.459 HD22 ' HA ' ' A' ' 12' ' ' LEU . 1.0 OUTLIER 75.53 -61.46 0.47 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.729 175.6 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.98 -41.37 64.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.161 0.505 . . . . 0.0 110.5 -178.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.21 6.39 8.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.901 -178.29 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.519 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 15.2 m -72.92 -25.78 61.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.14 174.168 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.94 -53.51 0.51 Allowed 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.906 0.754 . . . . 0.0 111.354 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.616 ' HB1' ' HB2' ' A' ' 116' ' ' LYS . . . -63.1 -33.01 74.54 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.858 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.605 ' HE2' ' SG ' ' A' ' 34' ' ' CYS . 15.9 t80 -72.14 -28.46 63.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.151 177.271 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.33 -22.32 63.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.748 177.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.542 ' HE2' ' HA ' ' A' ' 17' ' ' ALA . 55.4 mttm -67.63 -29.58 68.94 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.146 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.82 -31.91 73.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.639 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.13 -18.63 63.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.526 -177.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -108.66 -25.1 11.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.783 179.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -77.13 -26.43 61.97 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.319 179.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.769 HG21 HG21 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -137.99 155.44 48.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.666 0.269 . . . . 0.0 110.433 -179.649 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.16 95.73 9.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.198 0.523 . . . . 0.0 110.414 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -148.44 132.25 17.01 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.642 175.908 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -80.38 173.71 12.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.318 -177.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.8 p -55.78 -41.76 67.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 120.751 0.31 . . . . 0.0 111.356 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -95.36 12.36 68.02 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.295 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.576 ' HA ' ' HA ' ' A' ' 99' ' ' PRO . 0.7 OUTLIER -130.68 16.35 5.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.949 0.404 . . . . 0.0 110.637 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -106.49 133.14 51.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 175.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.509 ' CB ' ' HB3' ' A' ' 98' ' ' CYS . . . -150.45 178.97 8.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.503 0.668 . . . . 0.0 112.319 -171.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.605 ' SG ' ' HE2' ' A' ' 18' ' ' PHE . 3.8 m -127.45 135.07 49.9 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.792 -1.095 . . . . 0.0 108.806 171.044 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.551 ' HB3' ' HB ' ' A' ' 94' ' ' ILE . 0.4 OUTLIER -110.92 158.41 18.77 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.111 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.643 ' OD1' ' HB3' ' A' ' 40' ' ' GLU . 11.0 t-20 -148.96 159.24 44.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.679 0.276 . . . . 0.0 110.843 -172.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.465 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -50.61 132.71 27.13 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.528 177.489 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 37' ' ' SER . 63.8 Cg_exo -53.38 -43.3 58.63 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.31 2.673 . . . . 0.0 113.42 -177.514 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.09 -8.12 52.82 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.969 0.414 . . . . 0.0 111.029 -177.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.643 ' HB3' ' OD1' ' A' ' 36' ' ' ASN . 1.5 tt0 -103.47 -46.81 4.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.563 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 43.8 m -60.18 -38.12 82.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.978 176.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.403 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -102.41 14.74 31.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.006 -177.541 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -62.4 -42.02 99.11 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.144 -177.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 1.046 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 21.7 t70 -87.57 140.88 29.07 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.531 178.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.26 -40.24 89.62 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.825 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.62 -19.73 22.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.046 -175.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 1.046 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -57.24 -35.64 69.96 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.209 -179.729 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.42 -23.32 67.35 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.87 0.366 . . . . 0.0 111.386 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -100.7 -19.07 18.83 Favored Glycine 0 C--N 1.33 0.229 0 N-CA-C 111.283 -0.727 . . . . 0.0 111.283 174.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.606 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 2.3 tp -64.34 -35.06 79.65 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 122.596 0.359 . . . . 0.0 110.904 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.57 ' HB2' HD22 ' A' ' 56' ' ' LEU . 0.2 OUTLIER -72.43 -34.55 67.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.172 0.511 . . . . 0.0 110.637 178.972 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.21 53.37 4.76 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.568 -175.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.79 -27.48 61.16 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.4 0.619 . . . . 0.0 110.527 178.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -137.9 -94.28 0.33 Allowed Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.519 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.58 ' HB3' ' HA2' ' A' ' 101' ' ' GLY . 0.5 OUTLIER -130.23 58.82 1.65 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.94 0.4 . . . . 0.0 110.027 178.448 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.57 HD22 ' HB2' ' A' ' 51' ' ' LEU . 0.5 OUTLIER -80.81 103.1 10.43 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.59 0.71 . . . . 0.0 110.146 177.885 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.436 ' ND2' ' H ' ' A' ' 57' ' ' ASN . 1.3 p30 -89.99 171.4 9.6 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 114.47 -1.241 . . . . 0.0 109.375 175.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.31 -160.12 34.3 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.581 -0.819 . . . . 0.0 113.168 -174.416 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.479 ' HA ' HD23 ' A' ' 59' ' ' LEU . 0.8 OUTLIER -67.98 159.33 30.88 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 122.545 0.338 . . . . 0.0 111.671 -178.303 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.586 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 0.4 OUTLIER -55.04 87.23 0.01 OUTLIER 'General case' 0 C--O 1.233 0.187 0 C-N-CA 123.841 0.856 . . . . 0.0 111.918 178.909 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.77 8.05 84.99 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.514 178.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -120.5 102.38 8.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.976 0.417 . . . . 0.0 111.509 -178.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.37 104.17 5.82 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.51 176.029 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 157.37 -61.38 0.33 Allowed Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.178 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.85 119.88 21.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.902 0.382 . . . . 0.0 110.073 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -114.27 135.83 53.64 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.197 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.07 132.36 56.68 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.882 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -103.78 129.32 51.18 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.055 0.455 . . . . 0.0 110.305 -177.199 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.474 ' HG3' ' HG2' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -75.63 168.03 20.79 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.323 -177.023 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.87 -31.88 67.13 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.678 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.6 -35.44 73.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.261 0.553 . . . . 0.0 109.541 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.696 HD12 HD11 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -76.89 -32.49 57.47 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.294 178.849 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.1 mt -60.81 -38.3 78.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.579 176.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.54 -24.47 49.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.033 177.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.408 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -77.04 -53.67 7.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.26 -0.427 . . . . 0.0 112.077 -175.406 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.606 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.9 OUTLIER -117.41 -24.43 7.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -172.9 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.89 50.59 6.85 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 119.974 -1.108 . . . . 0.0 112.367 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.696 HD11 HD12 ' A' ' 72' ' ' LEU . 2.4 mp -74.86 92.85 2.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.946 0.403 . . . . 0.0 110.735 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -77.46 6.51 6.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.713 -177.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.87 -44.86 79.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.236 0.541 . . . . 0.0 110.379 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.882 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -94.74 2.83 55.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.231 -176.808 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 16.3 t -115.22 138.29 46.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.234 0.54 . . . . 0.0 110.826 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.658 ' HB2' ' HD3' ' A' ' 92' ' ' LYS . 31.7 t0 -128.97 164.69 22.62 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 175.102 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -110.23 135.81 50.41 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.081 0.467 . . . . 0.0 111.513 -176.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.1 p -120.92 -169.51 1.84 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.343 176.268 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -66.93 -32.49 73.78 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.745 0.653 . . . . 0.0 109.941 174.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.519 ' HB3' ' O ' ' A' ' 15' ' ' SER . 0.5 OUTLIER -72.93 -54.81 7.72 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.873 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 166.43 -152.13 20.93 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.253 -0.975 . . . . 0.0 112.403 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -70.09 120.75 7.43 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 123.001 2.467 . . . . 0.0 111.022 174.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.4 -175.16 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.948 0.404 . . . . 0.0 111.064 -174.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.51 125.27 26.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.791 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.658 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 14.3 tptm -68.89 -41.46 78.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.82 -177.194 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -146.68 -63.36 0.3 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.575 -172.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.551 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 2.2 mt -109.19 122.15 63.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.99 0.424 . . . . 0.0 111.718 -173.042 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -85.46 126.92 40.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.806 175.527 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -154.29 152.58 30.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.303 -176.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 6.9 m -104.17 107.87 18.97 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 176.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.509 ' HB3' ' CB ' ' A' ' 33' ' ' ALA . 53.9 t -119.66 117.25 32.79 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.571 -173.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.66 ' HG2' HG21 ' A' ' 102' ' ' THR . 3.1 Cg_exo -80.01 154.8 22.76 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.047 2.498 . . . . 0.0 111.944 175.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.474 ' HG2' ' HG3' ' A' ' 69' ' ' LYS . 0.9 OUTLIER -88.27 100.89 13.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 171.885 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.58 ' HA2' ' HB3' ' A' ' 55' ' ' LEU . . . 110.73 68.42 0.57 Allowed Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.217 -0.992 . . . . 0.0 112.53 -178.12 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.66 HG21 ' HG2' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -146.28 -177.8 5.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.746 0.308 . . . . 0.0 111.081 -178.406 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 14.1 m -82.23 -47.88 11.92 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 172.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.586 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 18.0 p30 -154.63 163.69 39.86 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.138 174.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.509 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 34.7 m -112.34 141.99 45.4 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -97.25 132.21 42.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.184 0.516 . . . . 0.0 111.499 -172.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.45 130.97 35.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.503 173.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.769 HG21 HG21 ' A' ' 25' ' ' THR . 0.0 OUTLIER -108.98 25.13 2.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.938 -172.424 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -77.86 -55.48 5.28 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.501 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 9.0 m-80 69.06 -52.73 0.58 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.849 0.86 . . . . 0.0 112.157 177.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -129.19 -68.09 0.75 Allowed 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.987 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 170.51 89.35 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.185 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -79.8 -82.31 0.11 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.025 0.44 . . . . 0.0 110.19 178.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -166.96 -172.41 34.17 Favored Glycine 0 N--CA 1.445 -0.72 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.752 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.493 ' O ' ' HB3' ' A' ' 116' ' ' LYS . 0.8 OUTLIER -112.1 -15.98 13.14 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.585 0.231 . . . . 0.0 110.606 177.842 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.616 ' HB2' ' HB1' ' A' ' 17' ' ' ALA . 0.0 OUTLIER 164.71 3.39 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.21 -174.491 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ALA . . . . . 0.442 ' H ' ' H ' ' A' ' 116' ' ' LYS . . . -121.17 78.88 1.45 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.145 0.498 . . . . 0.0 110.28 -177.001 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.248 1.012 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.861 -177.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.885 0 CA-C-O 120.579 0.228 . . . . 0.0 110.435 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.6 OUTLIER -116.87 119.07 35.79 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 175.745 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 2' ' ' LEU . 13.5 Cg_exo -71.27 64.18 2.74 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.459 2.773 . . . . 0.0 112.922 -177.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -96.21 -10.92 26.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.474 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 71.9 m -156.07 152.91 28.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.289 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.39 26.08 14.91 Favored 'General case' 0 N--CA 1.466 0.327 0 O-C-N 123.899 0.749 . . . . 0.0 111.938 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -90.11 67.44 6.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.934 0.397 . . . . 0.0 110.652 -179.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.5 mttm -140.83 137.53 33.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.367 -179.026 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 77.88 -36.16 0.21 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.414 0.686 . . . . 0.0 111.446 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 72.59 -85.05 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.562 0.745 . . . . 0.0 111.96 177.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.528 ' HB3' ' H ' ' A' ' 12' ' ' LEU . 5.1 mtmm -148.15 -153.24 0.48 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.204 0.526 . . . . 0.0 112.18 -173.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.528 ' H ' ' HB3' ' A' ' 11' ' ' LYS . 6.3 mp -78.01 51.6 0.99 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.616 -175.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 69.26 -32.28 0.22 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.968 0.907 . . . . 0.0 111.774 -178.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.497 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -156.51 -57.42 0.09 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.432 ' OG ' ' HB3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER 47.6 46.78 17.86 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.189 -178.944 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.09 -62.02 2.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.943 0.401 . . . . 0.0 111.441 -173.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.467 ' HB1' ' HB3' ' A' ' 116' ' ' LYS . . . -76.11 -25.47 55.45 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.958 0.408 . . . . 0.0 110.76 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -64.66 -38.26 90.41 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.419 178.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.92 -19.92 64.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.492 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.88 -30.08 63.68 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.397 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -72.6 -26.16 61.59 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.289 176.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.0 -5.55 44.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.79 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -81.01 -21.36 40.27 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.151 0.501 . . . . 0.0 110.18 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.78 -27.71 49.51 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.703 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.415 ' OG1' HG11 ' A' ' 108' ' ' VAL . 0.3 OUTLIER -141.39 113.17 7.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.865 0.364 . . . . 0.0 110.942 -179.674 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.9 m -68.66 113.38 6.1 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.925 175.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.469 ' HB3' HG13 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -148.6 161.77 41.03 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.698 178.414 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.443 ' H ' ' HB2' ' A' ' 31' ' ' SER . 17.0 t-20 -87.44 171.49 10.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.777 -176.472 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.8 m -63.86 -36.81 77.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.831 0.348 . . . . 0.0 110.599 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -92.39 25.29 18.7 Favored Glycine 0 N--CA 1.451 -0.326 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 175.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.494 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 1.4 m -142.79 -9.19 0.81 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.069 0.462 . . . . 0.0 110.523 177.289 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.469 HG13 ' HB3' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -94.81 133.79 34.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 177.596 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.639 ' HB2' ' HG3' ' A' ' 69' ' ' LYS . . . -148.59 165.54 30.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.459 0.647 . . . . 0.0 112.625 -171.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.4 t -124.5 144.51 50.06 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.798 -1.092 . . . . 0.0 109.309 173.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.584 ' HB3' HG12 ' A' ' 94' ' ' ILE . 0.1 OUTLIER -124.41 155.53 38.67 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.771 0.319 . . . . 0.0 110.402 -179.311 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.424 HD22 ' HB2' ' A' ' 40' ' ' GLU . 1.6 t30 -134.59 159.49 41.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.737 178.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.38 142.9 67.58 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.789 178.652 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.415 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 74.2 Cg_exo -51.49 -33.04 45.73 Favored 'Trans proline' 0 N--CA 1.478 0.567 0 C-N-CA 123.797 2.998 . . . . 0.0 113.847 -174.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.83 -7.65 23.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.023 0.439 . . . . 0.0 111.56 -178.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.424 ' HB2' HD22 ' A' ' 36' ' ' ASN . 1.1 mt-10 -113.38 -39.98 3.98 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.202 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.19 -33.32 75.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.44 0.638 . . . . 0.0 110.61 176.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 2.2 m-80 -102.92 14.05 32.87 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.274 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -66.34 -28.95 69.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.614 -176.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.94 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 7.3 t0 -115.06 140.86 48.71 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.871 177.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -26.3 66.0 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.991 0.424 . . . . 0.0 110.745 177.486 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.466 ' HA ' HD13 ' A' ' 46' ' ' LEU . 1.0 OUTLIER -86.0 -24.0 26.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.175 177.756 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.94 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -62.12 -42.63 99.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.249 -177.436 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.591 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -65.38 -26.97 68.23 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.708 -175.562 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.84 -21.35 33.9 Favored Glycine 0 C--N 1.329 0.151 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.349 174.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.753 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 1.2 tp -70.72 -35.82 72.9 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.473 -0.363 . . . . 0.0 110.564 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.591 HD21 ' HA ' ' A' ' 48' ' ' SER . 1.6 pp -74.15 -26.13 60.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.241 -178.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.95 58.01 2.88 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.696 -177.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.701 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -79.55 59.61 3.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.075 0.464 . . . . 0.0 111.575 -176.492 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 120.22 70.14 0.31 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.615 176.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 15.0 mt 56.59 32.55 21.14 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.351 0.596 . . . . 0.0 111.363 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.88 145.0 31.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.099 -177.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.686 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 4.6 t-20 -120.68 -178.24 3.67 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.416 ' HA3' ' HA ' ' A' ' 66' ' ' ALA . . . -116.3 -122.7 3.44 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.521 -0.847 . . . . 0.0 112.245 -175.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.963 HD23 ' HB2' ' A' ' 65' ' ' SER . 1.8 mm? -65.31 144.09 57.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.683 0.277 . . . . 0.0 110.726 -179.276 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.58 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -58.17 94.16 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.813 -179.793 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.42 -8.02 79.51 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 121.125 -0.56 . . . . 0.0 113.237 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -105.57 141.46 36.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.446 0.641 . . . . 0.0 111.583 -175.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -104.37 136.37 44.08 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.78 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 112.74 -39.29 2.91 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.886 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.963 ' HB2' HD23 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -97.46 116.22 29.25 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.592 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.453 ' HB1' HD13 ' A' ' 51' ' ' LEU . . . -128.32 150.81 49.91 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.491 -178.577 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -129.97 146.72 51.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.673 0.273 . . . . 0.0 110.932 -177.019 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.516 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -114.83 155.21 27.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.156 178.083 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.639 ' HG3' ' HB2' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -100.44 174.85 5.91 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.814 -173.545 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.452 ' O ' ' HB ' ' A' ' 73' ' ' ILE . . . -61.3 -39.34 90.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.111 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.5 -36.42 83.79 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.979 0.418 . . . . 0.0 110.488 177.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.701 HD11 ' HB3' ' A' ' 53' ' ' ALA . 1.2 tp -72.88 -21.85 60.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.844 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.452 ' HB ' ' O ' ' A' ' 70' ' ' ALA . 0.2 OUTLIER -60.43 -40.22 83.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.874 176.369 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -88.27 2.17 52.96 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.317 0.58 . . . . 0.0 110.736 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.66 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 3.5 tp60 -94.23 -53.66 3.86 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.062 -177.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.753 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.8 OUTLIER -121.02 -16.05 8.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 -174.246 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.77 49.09 45.0 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.326 -0.94 . . . . 0.0 112.075 -179.048 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.44 ' H ' HD12 ' A' ' 78' ' ' LEU . 0.7 OUTLIER -76.72 98.47 4.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.905 0.383 . . . . 0.0 111.272 -176.194 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 3.82 11.3 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.406 179.259 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.46 -41.11 80.67 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -177.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.516 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -116.83 4.0 12.94 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -174.097 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.4 t -111.18 136.71 46.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.292 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.717 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 5.5 t0 -119.33 168.19 11.17 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -129.97 99.1 4.97 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.936 0.398 . . . . 0.0 111.189 -177.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 41.4 p -96.88 -169.09 1.81 Allowed 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 173.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -81.87 8.22 10.88 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.313 0.578 . . . . 0.0 110.081 175.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -104.74 4.29 32.24 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.645 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 99.69 -161.24 19.55 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.139 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -65.2 116.9 4.12 Favored 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.853 2.369 . . . . 0.0 111.237 173.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.515 ' HB ' ' HD3' ' A' ' 116' ' ' LYS . 2.5 m -134.19 177.78 6.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.04 0.448 . . . . 0.0 111.717 -172.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.7 130.89 44.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.473 177.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.717 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttm -82.38 -32.89 28.96 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.884 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -141.8 -94.55 0.13 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.768 -174.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.584 HG12 ' HB3' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -107.0 147.73 11.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.015 0.436 . . . . 0.0 111.217 -172.748 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.439 HG13 HG12 ' A' ' 108' ' ' VAL . 3.3 p -100.66 139.55 21.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.431 -179.221 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.49 160.67 41.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.001 0.429 . . . . 0.0 111.694 -175.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 1.3 m -104.89 107.73 18.86 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 174.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.689 ' HA ' ' HB3' ' A' ' 105' ' ' CYS . 9.9 t -124.62 108.47 28.79 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.901 -169.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.532 ' HD2' ' SG ' ' A' ' 105' ' ' CYS . 56.9 Cg_endo -69.47 126.71 13.83 Favored 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 122.633 2.222 . . . . 0.0 112.568 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.17 104.43 6.69 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 164.11 -67.46 0.22 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.399 -0.905 . . . . 0.0 112.687 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -161.59 159.13 27.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.751 0.276 . . . . 0.0 111.353 -177.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.563 HG22 ' H ' ' A' ' 104' ' ' ASN . 1.3 m 72.53 166.95 0.31 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.584 0.707 . . . . 0.0 112.699 171.263 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.686 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 11.5 p30 -74.46 163.5 27.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.312 -172.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.689 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 9.3 m -120.34 144.59 47.78 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.941 -175.538 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -90.66 148.31 4.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.482 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.52 140.39 43.36 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.497 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.439 HG12 HG13 ' A' ' 95' ' ' VAL . 0.8 OUTLIER -100.98 -0.26 10.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.512 0.672 . . . . 0.0 111.051 -178.341 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.414 ' OD2' ' HB ' ' A' ' 94' ' ' ILE . 1.9 t70 -99.01 163.72 12.47 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.284 176.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -130.57 -8.19 4.11 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.567 0.581 . . . . 0.0 112.567 -177.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -159.86 24.31 0.18 Allowed 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -174.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLY . . . . . 0.576 ' HA2' HG22 ' A' ' 94' ' ' ILE . . . 69.92 33.75 70.66 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.518 178.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.74 67.16 8.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.188 0.518 . . . . 0.0 110.623 -178.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -92.79 61.21 2.35 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.384 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.02 -21.32 64.13 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.645 0.259 . . . . 0.0 110.969 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.515 ' HD3' ' HB ' ' A' ' 90' ' ' VAL . 2.1 mtmp? 70.23 -74.12 0.09 Allowed 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 123.321 0.649 . . . . 0.0 110.866 -177.038 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -118.88 113.23 20.72 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 117.963 -1.018 . . . . 0.0 108.967 -177.007 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.457 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 1.1 mp -127.64 140.06 37.02 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.481 -179.081 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 2' ' ' LEU . 11.9 Cg_exo -70.78 -36.42 8.11 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.803 2.335 . . . . 0.0 112.082 177.64 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 54.88 31.93 16.79 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 175.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.8 m 63.23 21.58 12.91 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.805 -178.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.41 -9.45 35.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.471 176.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.29 -85.28 0.34 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.613 -175.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.9 tttt 59.4 60.1 2.43 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.312 0.577 . . . . 0.0 109.462 -172.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -100.72 -43.29 6.18 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.562 -171.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 48.69 74.4 0.18 Allowed 'General case' 0 C--O 1.233 0.217 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 178.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 59.8 mttt -58.94 -82.91 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 172.622 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 68.3 -55.78 0.51 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 114.647 -1.16 . . . . 0.0 112.162 176.716 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.14 -32.18 38.95 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.631 -177.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.73 5.11 4.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.863 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 87' ' ' GLU . 94.5 p -80.97 -34.33 33.2 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.279 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.09 -53.22 0.47 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.914 0.886 . . . . 0.0 111.27 -175.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.66 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . . . -66.82 -24.55 66.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.77 -177.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.631 ' HB2' HG12 ' A' ' 90' ' ' VAL . 36.3 t80 -87.9 -25.99 22.96 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.17 174.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.43 -40.21 93.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.272 178.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.66 ' HD3' ' HA ' ' A' ' 17' ' ' ALA . 0.0 OUTLIER -69.54 -24.51 63.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.462 0.649 . . . . 0.0 109.815 176.599 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -74.63 -34.01 62.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.05 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.68 ' HB1' HD11 ' A' ' 32' ' ' ILE . . . -67.78 -18.51 64.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.758 -177.325 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -87.05 -1.14 57.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.984 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -73.98 -26.37 69.09 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.069 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.56 172.32 13.06 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.99 96.9 1.36 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.986 0.422 . . . . 0.0 109.936 173.174 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 66.7 m -130.49 134.59 47.2 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.85 -175.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -145.45 -163.08 1.64 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.463 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 p -61.96 135.23 26.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.996 0.427 . . . . 0.0 110.121 177.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.93 -8.19 4.82 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 120.964 -0.636 . . . . 0.0 113.226 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -114.1 -6.35 13.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.952 0.405 . . . . 0.0 110.698 179.936 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.68 HD11 ' HB1' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -91.68 128.79 43.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.84 177.2 10.03 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.063 0.458 . . . . 0.0 111.707 -174.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.3 m -140.54 147.47 39.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.625 173.035 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -128.33 160.27 32.71 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.238 0.542 . . . . 0.0 111.039 -176.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 42.6 t-20 -153.78 159.98 42.09 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.129 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -48.58 137.88 12.13 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 123.636 0.585 . . . . 0.0 111.452 177.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.589 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 10.0 Cg_endo -52.91 -35.21 69.88 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.281 2.654 . . . . 0.0 112.94 -179.398 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.44 -19.88 62.47 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.82 0.343 . . . . 0.0 111.735 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -91.92 -52.45 4.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.136 0.493 . . . . 0.0 110.018 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.552 ' O ' ' HB3' ' A' ' 47' ' ' LEU . 1.2 t -69.99 -21.05 63.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.643 -177.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.589 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.3 m120 -105.94 7.46 32.1 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.478 -179.043 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -66.8 -34.49 77.93 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.323 0.582 . . . . 0.0 110.704 -178.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 1.099 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 13.3 t0 -96.37 134.68 39.22 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.216 177.479 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.19 -24.82 68.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.815 0.341 . . . . 0.0 111.244 -179.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.2 tp -91.76 -22.08 20.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.935 0.398 . . . . 0.0 110.831 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 1.099 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -66.08 -31.68 72.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.007 -177.144 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.593 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -67.94 -14.52 63.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.243 -179.052 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -104.82 -20.03 10.37 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.598 173.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.463 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 1.1 mp -73.35 -22.37 60.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.889 0.376 . . . . 0.0 111.185 -177.053 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.593 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.3 OUTLIER -75.63 -12.55 60.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.327 -178.737 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.434 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -138.27 86.53 0.22 Allowed Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.561 -178.629 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.59 ' HB2' HD21 ' A' ' 72' ' ' LEU . . . -65.37 -21.69 66.71 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -177.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.59 67.12 0.37 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.353 -0.927 . . . . 0.0 113.044 179.373 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 mp 61.49 40.89 13.28 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.157 0.503 . . . . 0.0 111.74 173.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.451 HD11 ' H ' ' A' ' 101' ' ' GLY . 0.1 OUTLIER -72.86 172.45 10.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.414 -178.371 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -117.03 -177.83 3.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.86 -176.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -116.34 -151.49 9.65 Favored Glycine 0 C--O 1.228 -0.271 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.209 -175.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.415 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -66.43 134.75 53.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.839 0.352 . . . . 0.0 110.308 177.958 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.48 105.78 1.01 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.798 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 102.15 -38.7 3.06 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.453 176.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -95.98 102.87 14.72 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.666 0.27 . . . . 0.0 110.653 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.15 71.38 2.89 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.015 0.436 . . . . 0.0 111.103 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -160.83 -58.76 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.012 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.18 139.62 44.57 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.877 0.37 . . . . 0.0 111.158 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.31 131.68 48.65 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 m -115.71 131.69 56.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.103 0.477 . . . . 0.0 110.688 -176.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -104.37 144.0 32.24 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.849 -177.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.731 ' HG3' ' HG2' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -89.82 161.26 16.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.49 -174.088 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.595 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -58.38 -25.64 62.28 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -175.448 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.86 -27.15 60.14 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.808 0.813 . . . . 0.0 109.005 -177.647 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.59 HD21 ' HB2' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -90.93 -17.12 26.94 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.306 -178.461 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.616 HG12 HG21 ' A' ' 82' ' ' VAL . 1.3 mt -66.15 -39.42 84.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.3 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.22 7.91 20.32 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.126 0.489 . . . . 0.0 110.731 177.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.504 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.8 OUTLIER -88.27 -53.41 4.71 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.763 -179.31 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.2 0.83 2.88 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -173.238 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.78 52.98 4.16 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 119.718 -1.229 . . . . 0.0 113.055 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.492 ' O ' HG23 ' A' ' 82' ' ' VAL . 4.5 mm? -67.97 66.56 0.1 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 122.663 0.385 . . . . 0.0 111.849 -178.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.34 -4.87 28.49 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -175.598 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.48 -31.23 42.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.76 0.314 . . . . 0.0 111.623 -176.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.0 mt -102.81 -21.95 13.96 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.955 0.407 . . . . 0.0 111.177 -174.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.616 HG21 HG12 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -110.28 138.17 39.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.196 178.971 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.695 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 16.5 t0 -110.78 158.66 18.42 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.748 176.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -116.28 116.33 27.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.257 0.551 . . . . 0.0 111.575 -177.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.5 p -107.94 -175.47 2.79 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.397 -0.82 . . . . 0.0 108.873 174.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -66.12 -27.74 68.28 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.805 0.336 . . . . 0.0 111.448 -177.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 15' ' ' SER . 1.1 pm0 -70.65 -39.59 73.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.032 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 151.62 -159.79 28.45 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.108 -178.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -71.57 122.31 8.48 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 123.056 2.504 . . . . 0.0 111.286 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.631 HG12 ' HB2' ' A' ' 18' ' ' PHE . 1.5 m -138.51 169.83 17.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.76 -175.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.56 127.21 31.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.724 0.297 . . . . 0.0 110.481 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.695 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 2.0 tttt -67.36 -64.45 0.85 Allowed 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.082 -173.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.48 -61.8 1.37 Allowed 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.512 -172.259 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.9 mt -108.83 119.24 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.107 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.4 p -79.85 112.05 17.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.416 0.627 . . . . 0.0 109.831 175.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -151.02 137.69 18.83 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.068 -176.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 1.2 m -104.66 149.87 25.19 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.975 0.417 . . . . 0.0 110.482 -176.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 31' ' ' SER . 7.2 t -148.08 136.35 11.25 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.079 -167.456 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -81.95 152.19 16.62 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.701 2.267 . . . . 0.0 111.927 178.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.731 ' HG2' ' HG3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -89.43 157.24 18.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.864 0.364 . . . . 0.0 110.094 175.532 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.451 ' H ' HD11 ' A' ' 56' ' ' LEU . . . 96.87 -56.31 1.32 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.068 -0.587 . . . . 0.0 111.99 -178.16 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.7 t -177.97 -173.77 0.4 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.7 m 74.75 148.66 0.1 Allowed 'General case' 0 C--N 1.33 -0.251 0 O-C-N 123.849 0.718 . . . . 0.0 111.195 -177.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -74.29 174.6 8.59 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.467 -175.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.98 146.82 34.61 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.894 177.502 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -102.05 138.44 26.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.853 0.359 . . . . 0.0 110.356 -177.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -110.48 108.32 18.28 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 4.9 p -74.88 -4.15 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.735 0.779 . . . . 0.0 111.622 -173.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.585 ' O ' ' HB2' ' A' ' 110' ' ' ASN . 0.0 OUTLIER -119.56 -26.08 5.84 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.41 179.585 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.585 ' HB2' ' O ' ' A' ' 109' ' ' ASP . 3.7 m-80 78.68 -60.49 0.38 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.352 -174.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -179.06 108.17 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.962 179.028 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 155.33 -20.55 0.55 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.791 176.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.437 ' H ' ' CG ' ' A' ' 109' ' ' ASP . . . -121.37 129.22 52.92 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.298 0.571 . . . . 0.0 111.501 -177.187 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -176.74 -162.96 28.24 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 178.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 56.04 46.41 21.81 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 120.95 0.405 . . . . 0.0 111.608 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.479 ' HE3' ' HB2' ' A' ' 116' ' ' LYS . 6.4 mtmt 72.61 14.2 5.18 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.292 173.065 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -72.31 105.48 4.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.065 0.46 . . . . 0.0 111.677 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.544 ' HB3' ' NZ ' ' A' ' 20' ' ' LYS . 3.1 tm-20 . . . . . 0 C--O 1.244 0.812 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 121.083 0.468 . . . . 0.0 110.438 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.534 HD23 ' HD2' ' A' ' 3' ' ' PRO . 0.1 OUTLIER -159.07 145.48 12.5 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.58 -176.925 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.534 ' HD2' HD23 ' A' ' 2' ' ' LEU . 50.6 Cg_exo -55.16 -51.01 11.16 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.244 1.963 . . . . 0.0 110.957 174.441 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.554 ' HA ' ' HB3' ' A' ' 7' ' ' ALA . . . 54.9 29.14 11.55 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.53 173.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.84 -45.8 33.86 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.366 0.603 . . . . 0.0 109.602 175.105 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -132.31 52.61 2.06 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.465 176.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.554 ' HB3' ' HA ' ' A' ' 4' ' ' ALA . . . -136.87 130.85 32.34 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.396 -177.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.663 ' HG3' ' HA3' ' A' ' 77' ' ' GLY . 1.2 tptt 63.73 48.26 3.34 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.392 0.615 . . . . 0.0 110.481 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -77.98 58.58 1.98 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.045 -179.388 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.434 ' HB1' HG23 ' A' ' 73' ' ' ILE . . . -117.15 100.08 7.48 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.311 -179.544 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -98.69 -59.76 1.67 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.361 179.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.505 ' HG ' HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER 73.44 -48.91 0.68 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.519 0.728 . . . . 0.0 112.474 174.495 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.83 -30.83 71.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.923 0.392 . . . . 0.0 111.239 -179.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.31 -17.15 56.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.407 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.15 74.43 6.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.43 179.129 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.65 -40.14 62.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.549 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.58 -31.0 71.04 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.893 -177.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.559 ' HB2' HG12 ' A' ' 90' ' ' VAL . 88.8 t80 -70.18 -43.95 69.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.118 0.485 . . . . 0.0 110.111 -179.003 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.22 -30.24 48.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.366 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -63.3 -35.46 80.43 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.664 0.745 . . . . 0.0 109.237 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -30.43 67.17 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.526 176.223 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.56 -8.54 56.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.649 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.89 -5.62 59.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.031 0.443 . . . . 0.0 110.273 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.24 -9.16 55.93 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.156 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.5 m -134.57 152.78 52.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.82 95.58 7.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.14 0.495 . . . . 0.0 111.655 -177.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.497 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -140.95 155.91 46.16 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 173.206 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -112.85 -179.32 3.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.533 0.206 . . . . 0.0 110.481 -174.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.1 m -60.38 138.07 21.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 176.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 80.11 -13.84 24.12 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.321 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.693 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -104.93 -2.94 23.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.79 0.295 . . . . 0.0 111.228 179.556 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.418 ' H ' HG12 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -81.26 106.12 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 176.9 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.658 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -122.25 144.92 48.68 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.991 0.424 . . . . 0.0 111.649 -173.252 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 5.5 t -107.98 133.37 52.4 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.519 174.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.716 ' HB2' ' HB ' ' A' ' 94' ' ' ILE . 37.5 m -112.68 149.66 32.58 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.51 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.496 ' HB2' HD23 ' A' ' 81' ' ' LEU . 38.1 t-20 -136.56 152.8 50.89 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 174.5 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m -45.8 133.8 6.6 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 123.485 0.49 . . . . 0.0 110.884 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.4 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 6.3 Cg_endo -47.02 -44.92 22.25 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 124.043 3.162 . . . . 0.0 114.351 -172.585 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.1 -11.24 60.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.952 0.406 . . . . 0.0 111.835 -176.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.92 -38.66 6.91 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.558 HG23 HD13 ' A' ' 47' ' ' LEU . 1.4 m -60.26 -43.12 96.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.21 173.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.4 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 2.9 m-20 -90.01 5.88 44.68 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.192 -176.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -81.19 -7.61 59.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.427 0.632 . . . . 0.0 109.646 175.165 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -96.34 144.16 26.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.349 177.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -82.32 -21.68 35.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.329 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.545 ' HB3' HD11 ' A' ' 78' ' ' LEU . 3.2 mp -82.06 -52.86 6.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.619 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.784 ' HA ' ' HB3' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -54.05 -36.62 63.28 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.935 179.994 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 t -58.75 -25.23 62.79 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.401 -178.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -105.72 -24.06 7.19 Favored Glycine 0 C--N 1.334 0.422 0 N-CA-C 111.534 -0.627 . . . . 0.0 111.534 173.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.784 ' HB3' ' HA ' ' A' ' 47' ' ' LEU . 0.4 OUTLIER -67.87 -20.06 65.09 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 122.75 0.42 . . . . 0.0 110.783 179.189 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.484 ' HG ' ' CB ' ' A' ' 66' ' ' ALA . 0.0 OUTLIER -46.08 -35.23 4.73 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.652 0.595 . . . . 0.0 111.736 177.489 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.8 79.34 0.32 Allowed Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.485 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.414 ' CB ' HD11 ' A' ' 72' ' ' LEU . . . -67.53 -28.34 67.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.556 0.693 . . . . 0.0 109.251 174.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -133.96 -107.55 0.99 Allowed Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 110.361 -1.096 . . . . 0.0 110.361 172.349 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.1 mt -117.68 47.13 1.6 Allowed 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 174.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.408 HD11 ' OE2' ' A' ' 100' ' ' GLU . 2.2 mt -78.0 176.17 9.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.877 -174.157 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.579 ' CB ' ' HA ' ' A' ' 104' ' ' ASN . 3.0 m120 -138.83 -177.43 4.87 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.737 -175.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -112.41 -135.86 6.59 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.671 -0.775 . . . . 0.0 112.089 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.657 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -64.88 150.23 48.11 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.855 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.458 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -55.06 89.07 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.094 0.557 . . . . 0.0 112.099 -179.78 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.92 2.29 61.14 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 121.079 -0.582 . . . . 0.0 112.443 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.657 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 32.5 t-20 -122.35 98.22 5.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.944 0.402 . . . . 0.0 110.345 -179.003 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.16 72.7 9.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.237 0.542 . . . . 0.0 111.134 178.172 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.72 -48.17 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 -179.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -81.23 113.47 19.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 174.626 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.484 ' CB ' ' HG ' ' A' ' 51' ' ' LEU . . . -105.78 156.05 18.69 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.835 0.35 . . . . 0.0 111.011 -176.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.4 m -134.42 141.73 46.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.041 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.636 ' HB2' HD21 ' A' ' 50' ' ' LEU . . . -108.06 126.01 52.24 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.935 0.398 . . . . 0.0 110.454 176.776 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.658 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -80.77 166.42 21.0 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.694 175.758 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -50.72 -38.42 47.18 Favored 'General case' 0 C--N 1.329 -0.297 0 O-C-N 123.433 0.458 . . . . 0.0 111.813 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.3 -37.31 80.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.592 179.385 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.781 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -82.77 -23.24 34.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.71 -178.292 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.505 HG21 ' HG ' ' A' ' 12' ' ' LEU . 2.4 mt -63.88 -40.26 88.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 173.559 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -83.74 -4.34 58.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.118 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.781 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.3 OUTLIER -81.7 -53.46 6.2 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 120.972 0.415 . . . . 0.0 110.58 -179.245 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.557 HD22 ' HB2' ' A' ' 50' ' ' LEU . 6.7 mp -110.98 -21.92 11.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.015 -176.131 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.663 ' HA3' ' HG3' ' A' ' 8' ' ' LYS . . . 82.41 46.09 6.64 Favored Glycine 0 CA--C 1.511 -0.186 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.275 -176.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.727 HD13 HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -76.79 147.18 37.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -174.036 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.84 14.9 5.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.328 174.331 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.1 -25.65 43.01 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.023 0.44 . . . . 0.0 111.09 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.496 HD23 ' HB2' ' A' ' 36' ' ' ASN . 8.1 mt -109.68 4.13 21.66 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.704 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -116.71 138.24 47.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.353 0.597 . . . . 0.0 110.819 -176.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.625 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 6.8 t0 -119.62 144.12 47.3 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 175.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -103.94 112.15 25.0 Favored 'General case' 0 C--N 1.316 -0.854 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.067 -174.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.0 p -107.46 -169.36 1.52 Allowed 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.963 174.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.8 pm0 -61.62 -24.44 66.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.604 178.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.35 -34.41 31.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.727 0.299 . . . . 0.0 111.092 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 143.48 -160.03 27.6 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.115 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_exo -71.92 97.55 0.83 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.207 2.604 . . . . 0.0 111.463 175.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.559 HG12 ' HB2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -113.01 -174.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.899 -175.722 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.456 ' SG ' HG12 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -67.69 127.66 33.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.084 0.469 . . . . 0.0 110.832 -177.793 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.625 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 6.5 tptp -73.53 -36.73 65.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.622 -178.571 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -144.37 -78.53 0.2 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -170.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.844 HG23 ' HB3' ' A' ' 109' ' ' ASP . 4.6 mt -110.92 136.18 47.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.404 -170.666 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.456 HG12 ' SG ' ' A' ' 91' ' ' CYS . 13.2 m -101.76 139.65 22.36 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 120.738 0.304 . . . . 0.0 110.853 177.405 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -155.24 166.92 32.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.134 0.492 . . . . 0.0 111.81 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.497 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.8 m -113.2 117.71 32.65 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 173.468 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.693 ' O ' ' HA ' ' A' ' 31' ' ' SER . 39.8 t -123.6 124.46 26.21 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.504 -175.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -84.26 127.9 4.06 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.815 2.343 . . . . 0.0 113.028 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.408 ' OE2' HD11 ' A' ' 56' ' ' LEU . 0.7 OUTLIER -73.33 105.37 4.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.042 0.448 . . . . 0.0 110.519 175.074 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 169.54 -80.44 0.1 OUTLIER Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 176.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.51 161.32 32.74 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 122.728 0.411 . . . . 0.0 109.892 176.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 23.7 m 79.76 150.66 0.11 Allowed 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.779 0.674 . . . . 0.0 110.733 -179.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.579 ' HA ' ' CB ' ' A' ' 57' ' ' ASN . 0.3 OUTLIER -71.28 173.9 7.15 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -168.679 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.575 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.15 142.83 44.13 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.496 -177.624 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -99.16 127.91 51.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 121.061 0.458 . . . . 0.0 110.031 -177.29 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -94.48 136.01 35.27 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.818 177.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.71 -0.99 9.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.275 0.559 . . . . 0.0 111.271 -178.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.844 ' HB3' HG23 ' A' ' 94' ' ' ILE . 17.7 t0 -86.88 77.96 9.14 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.283 -179.726 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -138.53 -15.57 1.22 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.477 172.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -100.04 -1.7 36.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.005 176.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 104.96 93.77 2.32 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.738 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -92.76 -158.29 0.59 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 174.16 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -137.15 163.75 25.34 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.46 -0.876 . . . . 0.0 111.977 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.54 -62.19 1.5 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.351 0.596 . . . . 0.0 110.112 177.3 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.27 6.55 0.15 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.199 176.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -115.13 92.24 3.87 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.311 -174.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 . . . . . 0 C--O 1.251 1.144 0 CA-C-O 117.655 -1.164 . . . . 0.0 108.867 175.473 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.476 0.84 0 CA-C-O 120.738 0.304 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.472 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.2 OUTLIER -128.29 116.74 20.09 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-O 120.731 0.3 . . . . 0.0 110.725 -177.845 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 2' ' ' LEU . 4.4 Cg_exo -76.74 140.46 20.89 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.047 2.498 . . . . 0.0 111.304 176.662 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -149.59 -104.34 0.07 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.719 0.295 . . . . 0.0 110.564 -177.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.2 -20.95 60.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.198 0.523 . . . . 0.0 110.415 178.074 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -130.34 173.12 11.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.101 178.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 63.13 50.5 3.04 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.94 0.775 . . . . 0.0 111.227 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.41 37.77 2.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.946 -179.618 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -78.1 72.63 4.64 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.02 -178.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -87.73 -30.57 20.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.612 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -100.46 148.7 24.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.776 0.322 . . . . 0.0 110.478 -178.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.525 ' C ' ' H ' ' A' ' 14' ' ' THR . 7.9 mp -77.78 63.28 2.81 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.936 179.416 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 70.68 -24.98 0.16 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.808 0.843 . . . . 0.0 111.393 -178.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.525 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -170.57 -42.57 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.3 m 64.69 -74.45 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.416 -177.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.519 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . 52.99 -91.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.052 0.541 . . . . 0.0 111.307 -177.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.836 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . . . -63.15 -32.18 73.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.804 0.335 . . . . 0.0 110.526 177.065 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.523 ' HE2' ' SG ' ' A' ' 34' ' ' CYS . 28.5 t80 -68.71 -32.66 72.61 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.158 0.504 . . . . 0.0 110.05 176.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.34 -37.04 80.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.587 177.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.836 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 23.1 mttt -64.9 -36.96 86.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.38 0.609 . . . . 0.0 109.403 174.616 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -59.99 -40.87 90.63 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.309 174.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.21 -16.64 61.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.467 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.56 -40.44 11.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.658 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -75.83 -27.88 61.91 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.757 -177.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -114.33 146.23 40.78 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.586 0.231 . . . . 0.0 110.393 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.55 92.93 9.07 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 121.398 0.618 . . . . 0.0 111.208 -178.461 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.537 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -160.3 131.23 5.64 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 170.469 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -111.36 -175.15 2.63 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.517 -174.167 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.7 t -58.34 117.07 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.174 0.511 . . . . 0.0 109.849 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.538 ' O ' ' HA ' ' A' ' 99' ' ' PRO . . . 113.82 -23.68 12.87 Favored Glycine 0 N--CA 1.441 -1.001 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 -174.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.96 4.4 5.35 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.81 0.338 . . . . 0.0 111.2 178.325 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.448 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 5.3 tt -96.79 129.52 46.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.887 0.375 . . . . 0.0 110.807 -177.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.75 172.81 15.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.223 0.535 . . . . 0.0 111.929 -176.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.523 ' SG ' ' HE2' ' A' ' 18' ' ' PHE . 55.9 m -124.54 142.09 51.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.741 170.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -117.2 145.02 44.15 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.725 ' HB2' ' HB3' ' A' ' 81' ' ' LEU . 13.2 t-20 -131.6 159.74 37.37 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.942 0.401 . . . . 0.0 111.031 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -54.5 142.06 52.33 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.612 175.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.555 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 11.5 Cg_endo -55.39 -38.54 93.8 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 123.107 2.538 . . . . 0.0 112.795 -175.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.37 -16.69 64.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.963 0.411 . . . . 0.0 111.937 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -102.81 -42.68 5.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.526 179.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.66 -25.81 65.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.054 0.454 . . . . 0.0 110.841 178.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.555 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.3 m120 -104.84 14.29 29.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.4 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -62.32 -26.01 68.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.013 -175.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 1.026 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 14.6 t70 -122.03 150.85 41.51 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.588 0.232 . . . . 0.0 110.394 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.98 -35.03 79.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.216 -179.037 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.32 -15.99 26.64 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.464 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 1.026 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 5.0 tp -60.98 -40.94 95.35 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.085 -178.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -29.84 69.91 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.12 -177.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -84.59 -29.84 28.66 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.726 -0.749 . . . . 0.0 111.754 177.104 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.481 ' HA ' HD12 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -68.53 -20.81 64.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.919 0.39 . . . . 0.0 110.972 179.275 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.617 HD12 ' HB2' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -56.57 -30.99 63.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.236 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.608 ' HA3' ' HB2' ' A' ' 56' ' ' LEU . . . -137.24 100.07 0.31 Allowed Glycine 0 N--CA 1.441 -1.031 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.033 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.492 ' H ' HD21 ' A' ' 72' ' ' LEU . . . -75.1 55.14 0.72 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.107 0.479 . . . . 0.0 110.481 177.217 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 164.61 -118.08 0.79 Allowed Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.556 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.5 mp -120.02 52.89 1.1 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.933 0.397 . . . . 0.0 110.199 -177.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.608 ' HB2' ' HA3' ' A' ' 52' ' ' GLY . 0.3 OUTLIER -88.36 166.9 13.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.269 0.557 . . . . 0.0 111.828 -175.816 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.436 ' HB3' ' O ' ' A' ' 103' ' ' THR . 45.7 t30 -132.83 -179.13 5.29 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.384 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -101.64 -153.56 25.74 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.502 -0.856 . . . . 0.0 112.684 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.875 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 9.5 tp -67.38 143.47 56.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.561 0.22 . . . . 0.0 110.842 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.1 m -59.34 94.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.524 -179.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.62 -13.86 63.67 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.6 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.875 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 6.7 t-20 -99.72 92.22 5.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.021 0.439 . . . . 0.0 110.934 -177.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -76.14 72.22 2.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.049 176.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -179.46 -48.13 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.34 130.84 37.14 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.702 0.287 . . . . 0.0 110.397 176.733 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.02 164.58 14.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.204 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 0.2 OUTLIER -129.36 127.96 42.11 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 120.822 0.344 . . . . 0.0 110.169 -178.46 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 1.016 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -109.43 148.82 30.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.983 178.07 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' A' ' 32' ' ' ILE . 1.5 mppt? -92.46 168.25 11.4 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.614 -175.53 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.665 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -61.15 -32.62 72.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.197 -179.108 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.11 -48.6 77.84 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 176.173 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.514 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -57.78 -40.45 79.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.786 177.172 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.934 ' HA ' ' HB2' ' A' ' 78' ' ' LEU . 11.4 mt -60.73 -47.82 91.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.63 179.554 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.95 -30.64 70.83 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.1 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.437 ' C ' ' HG ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -62.58 -53.82 48.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.538 -171.231 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.437 ' HG ' ' C ' ' A' ' 75' ' ' GLN . 0.5 OUTLIER -138.67 25.53 2.59 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -171.247 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.508 ' O ' ' HG ' ' A' ' 79' ' ' LEU . . . 67.27 51.24 39.34 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 119.774 -1.203 . . . . 0.0 111.5 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.934 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 0.1 OUTLIER -73.53 72.57 1.4 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -174.227 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.798 ' HA ' ' HB ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -87.85 20.93 2.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.84 0.352 . . . . 0.0 110.905 178.092 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.432 ' HB2' ' HG ' ' A' ' 47' ' ' LEU . . . -65.1 -27.56 68.84 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.265 0.555 . . . . 0.0 110.558 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 1.016 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -132.52 13.09 4.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.123 179.502 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.798 ' HB ' ' HA ' ' A' ' 79' ' ' LEU . 53.8 t -115.36 137.3 49.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.615 -173.175 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -118.99 148.95 42.43 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 175.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 30.7 t-80 -109.87 115.49 29.91 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.089 -0.645 . . . . 0.0 111.65 -176.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.494 ' HB ' ' OE2' ' A' ' 87' ' ' GLU . 6.4 p -108.29 -173.92 2.39 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.466 174.518 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.47 -27.19 65.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.058 0.456 . . . . 0.0 110.051 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 16' ' ' ALA . 1.9 mp0 -68.33 -24.39 64.82 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.015 176.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 129.47 -158.54 22.17 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.418 178.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -73.79 120.21 6.29 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 123.188 2.592 . . . . 0.0 111.53 176.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.516 ' HB ' ' HE2' ' A' ' 116' ' ' LYS . 0.4 OUTLIER -137.56 166.86 23.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.282 -175.878 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 9.0 m -67.09 139.02 57.54 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.217 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.9 tttp -75.93 -49.85 16.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.643 -175.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -129.9 -86.0 0.53 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -170.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 5.6 mt -85.52 132.73 31.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.036 -168.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -94.5 123.79 46.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.386 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.428 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . . . -153.33 151.73 30.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.527 -178.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.537 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 3.7 m -105.45 123.59 48.14 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.281 0.562 . . . . 0.0 109.699 178.253 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 26.6 t -130.31 128.57 22.71 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.983 -172.439 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.538 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 10.5 Cg_exo -70.91 141.41 40.51 Favored 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.786 2.324 . . . . 0.0 112.275 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -88.2 103.99 16.29 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 171.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.437 ' H ' HD11 ' A' ' 56' ' ' LEU . . . 165.09 -78.65 0.13 Allowed Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.41 HG22 ' H ' ' A' ' 103' ' ' THR . 0.3 OUTLIER -155.33 -174.81 5.13 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.54 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.436 ' O ' ' HB3' ' A' ' 57' ' ' ASN . 23.8 p 62.99 178.22 0.15 Allowed 'General case' 0 C--O 1.235 0.302 0 O-C-N 124.177 0.923 . . . . 0.0 112.449 178.398 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -93.02 173.96 7.47 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.721 -168.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.442 ' O ' HD12 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -112.72 143.01 44.67 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.446 -176.308 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -87.46 141.82 13.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.917 0.389 . . . . 0.0 110.46 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.682 ' HB2' HD11 ' A' ' 59' ' ' LEU . . . -105.18 124.34 49.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.97 0.414 . . . . 0.0 110.902 -178.531 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -101.39 18.71 3.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.504 0.669 . . . . 0.0 109.828 178.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -76.65 70.3 3.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.208 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -135.6 20.52 3.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.779 -179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -113.04 166.4 11.45 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.354 -174.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -122.51 42.24 1.67 Allowed Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.947 -0.644 . . . . 0.0 111.529 179.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -103.73 -167.7 1.41 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.941 0.4 . . . . 0.0 110.753 -177.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -82.26 161.15 40.96 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.697 -0.763 . . . . 0.0 111.324 175.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.27 -56.31 23.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.15 0.5 . . . . 0.0 110.835 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.516 ' HE2' ' HB ' ' A' ' 90' ' ' VAL . 0.1 OUTLIER -168.04 24.42 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.688 175.909 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -103.36 79.14 1.68 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.409 -174.18 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.103 -0.951 . . . . 0.0 109.23 175.776 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -130.46 143.94 51.3 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.39 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -67.51 88.0 0.34 Allowed 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 122.625 2.217 . . . . 0.0 111.623 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.47 -48.67 68.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.891 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -148.52 -43.48 0.15 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.881 176.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -158.69 170.21 22.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.433 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -164.36 -68.19 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.66 177.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -163.51 44.47 0.11 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 176.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -90.02 114.74 26.67 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.949 -169.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 62.5 -169.92 0.18 Allowed 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.482 173.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.5 mttt 52.52 -143.44 0.7 Allowed 'General case' 0 C--N 1.338 0.092 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.752 -178.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.8 mp -96.1 51.3 1.22 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 177.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.403 ' O ' ' HB ' ' A' ' 14' ' ' THR . . . 54.04 67.09 1.06 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.607 -176.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.403 ' HB ' ' O ' ' A' ' 13' ' ' ALA . 37.4 m 79.28 -37.74 0.19 Allowed 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.245 -178.564 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.618 ' HB3' ' HB3' ' A' ' 18' ' ' PHE . 0.9 OUTLIER 54.41 53.11 11.29 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.855 0.36 . . . . 0.0 111.689 174.748 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.409 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . -58.16 -58.08 10.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.209 -177.558 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.634 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . . . -73.84 -16.96 61.12 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.249 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.618 ' HB3' ' HB3' ' A' ' 15' ' ' SER . 80.3 t80 -79.51 -35.75 39.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.863 0.364 . . . . 0.0 110.474 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.88 -30.43 71.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.862 0.363 . . . . 0.0 110.796 176.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.634 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 46.4 mttt -69.29 -20.47 63.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.399 0.618 . . . . 0.0 109.711 176.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.92 -46.12 10.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.401 177.521 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.79 -18.43 64.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.892 -171.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.1 -21.0 60.83 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.669 -177.453 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -101.36 3.5 54.36 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.39 -0.91 . . . . 0.0 112.75 -178.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.438 HG22 ' HB ' ' A' ' 108' ' ' VAL . 0.0 OUTLIER -121.99 134.25 54.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.933 0.366 . . . . 0.0 111.815 -175.381 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.48 96.97 4.84 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.178 174.597 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.588 ' SG ' ' HA ' ' A' ' 32' ' ' ILE . 0.5 OUTLIER -150.67 172.61 15.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.507 -179.289 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -123.85 159.39 29.71 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.739 -0.21 . . . . 0.0 110.589 -173.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 p -65.72 120.05 11.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.451 0.643 . . . . 0.0 110.144 178.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.84 -38.89 2.92 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.453 -175.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.8 OUTLIER -90.98 -1.62 57.8 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.032 0.444 . . . . 0.0 110.925 178.743 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.588 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 2.0 tt -80.25 134.47 27.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.406 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.644 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . . . -144.14 173.03 12.09 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.877 0.846 . . . . 0.0 113.115 -167.617 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 28.4 t -122.4 133.49 54.63 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.295 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.3 t -117.47 157.58 26.0 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.464 ' HB2' ' CD2' ' A' ' 81' ' ' LEU . 8.7 t-20 -149.07 159.33 44.33 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.743 -175.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.402 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.3 OUTLIER -53.82 135.62 55.98 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.641 174.676 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.454 ' HG3' ' OG ' ' A' ' 65' ' ' SER . 74.5 Cg_exo -47.29 -46.76 18.94 Favored 'Trans proline' 0 C--O 1.22 -0.388 0 C-N-CA 123.576 2.851 . . . . 0.0 113.834 -172.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.451 ' HA ' ' OD1' ' A' ' 42' ' ' ASN . . . -60.93 -9.41 4.17 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -173.628 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.593 ' O ' ' HB2' ' A' ' 43' ' ' ASN . 4.6 tt0 -112.49 -41.36 3.88 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.5 m -59.28 -42.89 92.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.957 0.884 . . . . 0.0 110.584 171.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.451 ' OD1' ' HA ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -87.8 11.06 16.45 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.885 -175.243 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.593 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 1.8 t-20 -51.55 -34.8 38.13 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.968 -174.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 1.053 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 28.5 t70 -116.13 147.38 41.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.872 0.368 . . . . 0.0 110.997 178.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -40.52 97.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.134 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.28 -29.05 26.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.752 0.311 . . . . 0.0 110.319 -178.748 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 1.053 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -55.12 -32.94 62.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.574 173.346 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.508 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -65.84 -9.8 32.23 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.443 179.547 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -116.52 -8.89 11.99 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 172.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.595 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 1.2 tp -84.06 -19.99 33.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.976 0.417 . . . . 0.0 110.964 -176.073 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.508 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.1 OUTLIER -67.24 -21.61 65.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.415 -179.091 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.13 91.77 0.28 Allowed Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.52 ' H ' HD21 ' A' ' 72' ' ' LEU . . . -58.49 -30.75 67.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.767 0.318 . . . . 0.0 111.757 -174.316 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -96.14 29.73 9.65 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.694 -179.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.0 mt 61.59 54.95 2.88 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.4 0.619 . . . . 0.0 109.8 -175.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.608 HD22 ' NZ ' ' A' ' 69' ' ' LYS . 0.5 OUTLIER -80.89 -161.97 0.44 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.229 -176.498 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.436 ' H ' ' CG ' ' A' ' 56' ' ' LEU . 7.9 t-20 -133.03 -177.17 4.39 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.234 -174.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -95.52 -144.2 16.24 Favored Glycine 0 C--N 1.314 -0.645 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -176.174 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.801 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -66.59 155.03 38.94 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 175.074 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.524 ' HA ' ' ND2' ' A' ' 104' ' ' ASN . 1.6 t -61.33 100.49 0.13 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.013 0.435 . . . . 0.0 111.322 -178.077 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.01 -0.4 69.25 Favored Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.142 -179.019 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.801 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 24.1 t-20 -128.95 97.04 4.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.109 0.481 . . . . 0.0 110.257 -176.152 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.06 71.09 10.26 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.334 0.588 . . . . 0.0 111.072 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -167.23 -50.92 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.134 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.454 ' OG ' ' HG3' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -89.75 79.87 6.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.139 0.495 . . . . 0.0 109.862 174.312 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.463 ' HB3' HD22 ' A' ' 51' ' ' LEU . . . -86.7 164.19 16.9 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.199 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.789 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -131.86 153.03 50.62 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.578 -179.028 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -116.67 138.74 51.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.244 -178.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.793 ' HE3' HD23 ' A' ' 72' ' ' LEU . 0.0 OUTLIER -88.28 165.45 15.01 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.962 -177.083 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.436 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -62.33 -25.31 67.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.108 0.48 . . . . 0.0 110.96 -179.257 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -32.39 70.24 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.441 0.639 . . . . 0.0 109.577 177.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.793 HD23 ' HE3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -73.9 -30.82 62.8 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.574 178.992 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.436 HD12 ' HA ' ' A' ' 70' ' ' ALA . 3.5 mt -67.87 -35.68 73.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.597 176.271 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -74.8 -31.43 61.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.933 177.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.08 -52.83 6.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.824 -176.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.535 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 2.8 mm? -105.64 -45.81 4.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.443 -173.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.54 49.59 5.1 Favored Glycine 0 CA--C 1.518 0.279 0 C-N-CA 119.994 -1.098 . . . . 0.0 112.533 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.468 ' HB3' HD11 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -77.59 106.68 9.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.893 0.378 . . . . 0.0 110.978 -179.239 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.621 ' HA ' HG12 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -66.87 -18.29 65.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.938 -177.909 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.73 -21.65 64.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.809 0.337 . . . . 0.0 111.357 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.464 ' CD2' ' HB2' ' A' ' 36' ' ' ASN . 1.9 mt -123.45 28.6 6.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.291 0.567 . . . . 0.0 111.298 -176.743 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.621 HG12 ' HA ' ' A' ' 79' ' ' LEU . 2.0 p -142.44 145.41 23.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.313 176.407 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.604 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 9.8 t70 -122.88 171.09 9.47 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.05 177.456 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.31 80.29 1.79 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.143 0.497 . . . . 0.0 111.223 -174.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.541 HG23 ' H ' ' A' ' 87' ' ' GLU . 1.6 t -78.86 171.81 14.65 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 172.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -51.4 -38.98 56.23 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -176.126 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.541 ' H ' HG23 ' A' ' 85' ' ' THR . 17.1 mt-10 -88.91 48.35 1.62 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.0 0.429 . . . . 0.0 111.886 -176.119 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.44 -175.78 49.56 Favored Glycine 0 CA--C 1.522 0.482 0 CA-C-N 115.82 -0.627 . . . . 0.0 113.993 172.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -62.96 138.09 66.14 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.985 2.456 . . . . 0.0 111.547 175.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.453 HG11 ' HB3' ' A' ' 17' ' ' ALA . 0.3 OUTLIER -149.51 173.43 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.152 -172.815 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 14.1 t -67.64 143.3 56.07 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 174.019 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.604 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 2.8 tttp -78.24 -46.3 20.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.38 -176.344 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.514 ' HB3' HG13 ' A' ' 94' ' ' ILE . 4.5 m-20 -142.89 -82.14 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.029 0.442 . . . . 0.0 111.948 -172.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.514 HG13 ' HB3' ' A' ' 93' ' ' ASN . 2.1 mt -96.65 130.31 45.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.237 -170.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.3 p -83.42 138.06 19.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.668 0.27 . . . . 0.0 110.371 176.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.41 ' HA ' HG23 ' A' ' 108' ' ' VAL . . . -148.68 164.18 35.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.017 0.437 . . . . 0.0 111.926 -175.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.55 122.28 46.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.314 175.542 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.789 ' SG ' ' HB2' ' A' ' 67' ' ' CYS . 57.0 m -132.71 127.58 20.49 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.516 -173.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -86.89 178.11 3.8 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.118 1.879 . . . . 0.0 110.965 173.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.458 ' HA ' HD13 ' A' ' 56' ' ' LEU . 1.0 OUTLIER -123.94 157.52 34.12 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 168.99 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 102.26 -45.15 1.4 Allowed Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.865 -178.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.42 HG23 ' OG1' ' A' ' 103' ' ' THR . 10.5 t -177.92 174.97 1.36 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.824 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.6 OUTLIER 68.52 -175.11 0.2 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.594 176.672 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.824 ' H ' HG22 ' A' ' 103' ' ' THR . 10.9 p30 -104.91 -178.9 3.79 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.079 -164.016 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 68.6 m -112.52 143.48 43.6 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.858 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 86.9 t -103.71 113.33 40.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.176 175.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.98 118.32 18.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 174.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.438 ' HB ' HG22 ' A' ' 25' ' ' THR . 0.1 OUTLIER -96.05 17.61 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.806 -170.575 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -115.73 106.34 13.76 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.556 0.693 . . . . 0.0 110.191 174.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -128.56 30.9 5.07 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 114.869 -1.06 . . . . 0.0 108.619 173.13 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -128.45 -39.54 1.67 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.882 -177.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 96.74 86.79 1.8 Allowed Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.359 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -86.84 -151.81 0.17 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.888 0.375 . . . . 0.0 111.008 177.087 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -102.0 -115.29 3.96 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.642 -0.79 . . . . 0.0 111.557 175.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.532 ' O ' ' HG3' ' A' ' 116' ' ' LYS . 1.7 p -104.64 -36.14 7.57 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 173.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 115' ' ' THR . 2.0 mtmm -158.02 -83.77 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.563 -1.199 . . . . 0.0 108.683 175.727 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -120.49 78.44 1.37 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 173.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 . . . . . 0 C--O 1.253 1.286 0 CA-C-O 117.774 -1.108 . . . . 0.0 109.973 -177.389 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.775 0 CA-C-O 120.432 0.158 . . . . 0.0 110.613 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.5 145.25 98.94 Favored Pre-proline 0 C--O 1.233 0.211 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.543 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -75.04 64.46 6.08 Favored 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 122.722 2.281 . . . . 0.0 112.693 -178.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.48 -55.72 4.84 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.172 0.511 . . . . 0.0 110.158 178.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.3 -0.39 46.65 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.301 176.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 72.95 -45.63 0.63 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.303 177.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 60.97 47.74 7.2 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.438 0.637 . . . . 0.0 110.684 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.8 mttt -128.17 112.86 14.99 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.042 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.38 -171.9 2.04 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.68 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -98.76 16.11 23.22 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.739 -175.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.9 mtmt -110.27 102.45 11.11 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.46 HD22 ' HB2' ' A' ' 70' ' ' ALA . 0.0 OUTLIER -73.41 86.36 1.52 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.24 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 74.76 -44.47 0.55 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.212 -172.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.437 ' O ' ' HB2' ' A' ' 15' ' ' SER . 0.5 OUTLIER -158.44 -40.16 0.06 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.79 -177.961 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.437 ' HB2' ' O ' ' A' ' 14' ' ' THR . 2.7 m 69.75 -69.32 0.17 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.513 -177.299 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 47.26 -92.58 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.475 0.71 . . . . 0.0 112.154 178.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.521 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . . . -62.9 -30.53 71.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.191 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.63 ' HB2' HG12 ' A' ' 90' ' ' VAL . 15.3 t80 -67.12 -27.6 67.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 110.305 177.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.87 -20.85 60.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.539 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.521 ' HD3' ' HA ' ' A' ' 17' ' ' ALA . 5.0 mtpp -71.83 -26.84 62.54 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.569 ' HG3' ' HA ' ' A' ' 116' ' ' LYS . 0.0 OUTLIER -86.34 -36.57 19.16 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 113.893 -1.503 . . . . 0.0 110.541 179.29 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.67 -14.0 61.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.055 -174.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -109.15 16.77 22.25 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.445 0.641 . . . . 0.0 110.442 175.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -115.86 -27.67 2.92 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.22 174.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.67 142.22 34.71 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -91.12 96.7 10.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.932 0.396 . . . . 0.0 110.741 178.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.444 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 81.6 m -148.92 -179.04 6.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -98.73 159.87 14.66 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.425 ' H ' HG22 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -64.12 -49.48 81.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 120.798 0.332 . . . . 0.0 111.581 -178.113 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.21 -27.67 57.46 Favored Glycine 0 CA--C 1.509 -0.3 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.803 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -100.77 46.17 0.95 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.717 0.294 . . . . 0.0 111.218 -175.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.3 tt -112.32 138.84 39.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 174.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.405 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -146.54 155.32 42.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.536 0.684 . . . . 0.0 112.626 -171.434 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.6 m -109.88 133.23 53.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.637 174.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.41 ' HA ' HD22 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -123.13 165.13 17.36 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.6 -178.387 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.421 ' HB3' ' OG1' ' A' ' 41' ' ' THR . 3.2 t30 -149.29 161.16 42.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.71 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -49.02 127.36 14.73 Favored Pre-proline 0 C--O 1.237 0.398 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.572 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.465 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 31.4 Cg_exo -47.93 -47.45 18.93 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 123.815 3.01 . . . . 0.0 113.925 -178.145 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.51 -20.58 56.49 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -173.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -102.91 -48.57 4.03 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.033 0.444 . . . . 0.0 109.839 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.448 HG21 HD21 ' A' ' 81' ' ' LEU . 88.1 m -59.31 -35.95 74.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.564 177.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.4 m-80 -103.88 14.69 30.29 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.316 -173.592 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -69.08 -21.64 64.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.217 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.928 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.0 t70 -103.66 152.76 21.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.495 179.252 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.91 -29.41 44.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.743 0.306 . . . . 0.0 111.441 -177.405 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.469 ' HG ' HD13 ' A' ' 50' ' ' LEU . 9.6 tp -90.03 -36.98 14.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.698 0.285 . . . . 0.0 110.493 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.928 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.4 OUTLIER -50.47 -38.69 45.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.67 178.058 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.424 ' HA ' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -63.97 -28.18 69.64 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.573 -176.349 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -95.31 -25.1 14.66 Favored Glycine 0 C--N 1.33 0.207 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.626 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.557 ' HB3' HD21 ' A' ' 78' ' ' LEU . 1.2 tp -63.64 -32.89 74.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.969 0.414 . . . . 0.0 110.623 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 47' ' ' LEU . 7.6 mt -60.53 -39.89 89.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.631 177.411 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.694 ' HA2' ' HG ' ' A' ' 56' ' ' LEU . . . -87.08 67.6 3.34 Favored Glycine 0 N--CA 1.443 -0.865 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.654 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -68.5 -23.85 64.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.435 0.636 . . . . 0.0 110.437 -176.593 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -124.55 25.66 5.89 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.046 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 63.74 39.26 8.65 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.471 0.653 . . . . 0.0 109.86 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.694 ' HG ' ' HA2' ' A' ' 52' ' ' GLY . 0.7 OUTLIER -80.32 179.66 7.57 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.038 177.392 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.936 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 7.9 t-20 -118.75 -177.27 3.27 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.37 -175.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -97.93 -143.06 14.1 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.453 -176.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.553 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -65.54 148.89 50.97 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 178.957 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.569 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -57.24 90.28 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.64 -178.684 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.78 -10.34 70.54 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.86 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.553 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 57.9 t30 -117.55 105.93 12.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.284 0.564 . . . . 0.0 111.72 -174.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.44 131.5 42.65 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.359 178.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.48 -56.44 0.73 Allowed Glycine 0 CA--C 1.509 -0.325 0 C-N-CA 121.1 -0.571 . . . . 0.0 111.954 177.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.2 90.97 4.92 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.97 0.414 . . . . 0.0 110.42 178.008 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.02 160.74 16.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.079 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 64.7 m -126.55 130.84 51.34 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.061 0.457 . . . . 0.0 110.994 -178.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -105.49 125.83 51.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.578 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.452 ' NZ ' ' HA ' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -82.66 167.47 18.22 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.771 -178.555 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.46 ' HB2' HD22 ' A' ' 12' ' ' LEU . . . -60.55 -30.28 69.68 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.301 0.572 . . . . 0.0 109.997 175.475 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -23.12 63.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.511 176.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.823 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 1.3 tp -87.65 -24.03 24.05 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.501 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -60.29 -38.01 75.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.152 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -90.52 -5.11 56.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.408 0.623 . . . . 0.0 110.704 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.823 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -87.38 -54.16 4.44 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.138 -176.798 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.486 ' HA ' HD13 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -126.73 -9.91 6.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.509 -176.495 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 67.33 47.93 60.92 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.407 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.557 HD21 ' HB3' ' A' ' 50' ' ' LEU . 65.6 mt -71.19 129.91 40.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.653 0.263 . . . . 0.0 111.264 -178.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.63 4.16 19.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.093 177.09 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.49 -29.56 62.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.098 -174.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.448 HD21 HG21 ' A' ' 41' ' ' THR . 0.0 OUTLIER -128.89 4.92 5.4 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.973 0.416 . . . . 0.0 111.355 -174.666 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 6.2 t -111.11 137.66 42.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.885 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.904 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 6.9 t0 -115.47 154.61 28.99 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.7 m80 -125.87 114.6 18.76 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.316 0.579 . . . . 0.0 110.179 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.07 -169.96 1.56 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.143 -177.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -72.63 -19.75 61.39 Favored 'General case' 0 C--N 1.323 -0.57 0 O-C-N 123.335 0.397 . . . . 0.0 111.0 -178.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -89.14 -14.05 37.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.01 177.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 128.85 -152.79 19.47 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.516 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -79.51 129.59 8.49 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 123.321 2.68 . . . . 0.0 111.91 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.925 HG11 ' HD3' ' A' ' 116' ' ' LYS . 3.1 m -149.55 -178.56 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.237 -175.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.92 133.7 43.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.237 177.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.904 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 8.1 tttp -74.98 -49.92 18.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.545 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -136.84 -74.91 0.42 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.149 -172.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.0 mt -98.93 138.63 22.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.602 -171.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.4 p -112.27 138.93 39.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.478 ' CB ' ' HA ' ' A' ' 107' ' ' ALA . . . -150.2 168.93 22.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.05 0.452 . . . . 0.0 111.867 -176.121 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.444 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -112.03 117.17 31.95 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 171.944 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.479 ' HA ' ' HB3' ' A' ' 105' ' ' CYS . 44.5 t -138.69 139.76 25.31 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.673 0.273 . . . . 0.0 111.735 -170.529 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -82.86 -178.42 3.88 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 123.35 2.7 . . . . 0.0 112.093 176.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.452 ' HA ' ' NZ ' ' A' ' 69' ' ' LYS . 3.2 tp10 -80.18 -30.63 38.82 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -177.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.594 ' HA2' ' HA ' ' A' ' 56' ' ' LEU . . . -178.82 64.56 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 119.532 -1.318 . . . . 0.0 113.202 -178.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -153.94 108.54 3.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.601 0.239 . . . . 0.0 110.471 175.084 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 54.61 -176.25 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.669 0.747 . . . . 0.0 112.52 -178.169 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.936 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -74.42 165.44 25.19 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.734 -178.009 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.479 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 2.5 m -111.03 143.16 42.16 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.002 -175.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.0 p -85.35 120.79 36.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.125 0.488 . . . . 0.0 111.254 -176.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.529 ' HB3' HD11 ' A' ' 59' ' ' LEU . . . -96.88 125.76 41.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.144 175.554 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -89.38 10.52 2.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.109 0.48 . . . . 0.0 110.945 -178.173 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.504 ' O ' ' HB3' ' A' ' 110' ' ' ASN . 21.2 t0 -74.39 139.22 43.9 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.306 179.381 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.504 ' HB3' ' O ' ' A' ' 109' ' ' ASP . 3.9 p30 168.13 -14.47 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.301 1.001 . . . . 0.0 109.306 -176.778 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -71.36 -44.57 64.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.414 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 112.7 114.19 3.27 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.478 -0.868 . . . . 0.0 112.492 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . 62.27 53.14 2.91 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.256 0.551 . . . . 0.0 111.139 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -109.07 65.9 0.24 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.417 -0.897 . . . . 0.0 113.234 -177.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.45 -44.34 11.4 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 176.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.925 ' HD3' HG11 ' A' ' 90' ' ' VAL . 7.4 mtmt -151.52 147.49 26.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.56 178.533 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -79.65 121.84 25.8 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 173.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.77 -0.633 . . . . 0.0 110.881 -176.784 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -126.78 144.91 51.65 Favored Pre-proline 0 C--N 1.327 -0.395 0 O-C-N 122.309 -0.244 . . . . 0.0 110.764 -177.158 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -66.06 -17.06 54.49 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 122.565 2.177 . . . . 0.0 112.466 177.318 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 59.27 34.4 23.0 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.929 175.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 29.5 m 69.95 7.3 6.16 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 178.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.04 -63.65 1.06 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 176.119 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -80.03 124.38 28.67 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 170.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.4 43.31 2.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.133 0.492 . . . . 0.0 110.833 -174.588 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -136.83 135.67 38.14 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.742 179.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -139.78 50.13 1.76 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.013 0.435 . . . . 0.0 110.705 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -119.72 177.8 4.82 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.7 177.362 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.614 ' HG ' ' CD2' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -80.66 57.79 3.06 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 173.325 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 70.88 -53.42 0.67 Allowed 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.59 0.756 . . . . 0.0 109.752 -167.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.61 -34.12 0.19 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.344 175.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.526 ' CB ' ' HB2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER 62.53 32.34 16.57 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.398 -0.819 . . . . 0.0 112.096 175.467 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.1 -37.92 84.76 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.136 0.493 . . . . 0.0 110.073 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.37 -33.63 19.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.552 177.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.614 ' CD2' ' HG ' ' A' ' 12' ' ' LEU . 87.7 t80 -69.66 -44.35 70.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.453 -177.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.44 0.67 0.66 Allowed 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.682 ' HB3' ' HB ' ' A' ' 115' ' ' THR . 0.0 OUTLIER -73.37 -5.89 42.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.623 0.725 . . . . 0.0 109.112 176.178 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.556 ' HB3' HD11 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -82.88 -8.82 59.54 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.377 176.97 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -109.11 3.76 22.29 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.757 175.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.47 ' OE1' ' HG3' ' A' ' 20' ' ' LYS . 41.6 mt-10 -115.68 -75.97 0.58 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.734 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -70.07 -42.52 67.62 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.893 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.472 ' OG1' ' HA ' ' A' ' 21' ' ' GLN . 0.2 OUTLIER -83.82 132.05 34.84 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.397 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.88 95.32 7.3 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.232 0.539 . . . . 0.0 110.681 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 60.7 m -144.56 -178.32 5.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.256 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -110.84 148.36 32.57 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.9 t -66.87 -47.43 82.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.912 0.387 . . . . 0.0 110.744 -177.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.73 18.51 5.81 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.322 177.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -152.42 38.0 0.54 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.107 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.556 HD11 ' HB3' ' A' ' 21' ' ' GLN . 0.2 OUTLIER -96.57 136.56 27.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.087 -178.964 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.477 ' HB2' ' HB3' ' A' ' 98' ' ' CYS . . . -149.53 -179.72 7.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.18 0.514 . . . . 0.0 112.204 -175.001 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.549 ' SG ' ' HE1' ' A' ' 18' ' ' PHE . 64.8 m -131.81 144.82 51.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.814 175.569 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.443 ' HA ' ' HG ' ' A' ' 81' ' ' LEU . 0.9 OUTLIER -134.72 165.08 26.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.645 0.26 . . . . 0.0 110.568 -176.105 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.461 ' CB ' HD12 ' A' ' 81' ' ' LEU . 33.7 t-20 -154.08 161.16 42.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.258 177.69 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.5 m -53.99 146.92 26.79 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.139 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.428 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 46.4 Cg_exo -56.58 -33.74 93.75 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 123.05 2.5 . . . . 0.0 113.004 -175.633 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.05 -14.87 63.32 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.61 -48.7 3.37 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.311 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.72 ' HA ' ' HB1' ' A' ' 80' ' ' ALA . 3.1 m -56.29 -36.28 68.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.468 178.518 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.8 m-80 -105.58 14.23 28.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.847 -174.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -62.53 -26.49 68.59 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.952 0.406 . . . . 0.0 111.178 -175.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.829 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 8.0 t70 -119.02 146.16 45.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.683 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -24.85 62.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.105 0.479 . . . . 0.0 111.122 -179.342 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.2 tp -90.83 -23.58 20.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.104 177.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.829 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.7 OUTLIER -60.01 -45.92 91.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.876 179.99 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.8 -32.87 74.64 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.931 -178.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -75.86 -22.3 74.78 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 121.011 -0.614 . . . . 0.0 111.778 176.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.574 ' HG ' ' HB3' ' A' ' 76' ' ' LEU . 0.7 OUTLIER -75.44 -26.17 58.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.038 0.447 . . . . 0.0 109.855 177.881 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.747 HD11 HD21 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -67.33 -40.33 85.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.716 179.139 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.66 72.19 1.72 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.336 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.37 -17.04 61.86 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.165 0.507 . . . . 0.0 110.312 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.24 47.46 0.8 Allowed Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.619 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.9 mt 55.39 51.79 12.38 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.181 0.515 . . . . 0.0 110.743 -177.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.726 HD21 ' H ' ' A' ' 101' ' ' GLY . 12.8 mt -88.84 172.27 9.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.887 -177.343 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.504 ' HB2' ' C ' ' A' ' 103' ' ' THR . 0.8 OUTLIER -114.59 -178.39 3.36 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.378 174.997 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -99.46 -131.88 7.49 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.346 -0.93 . . . . 0.0 111.025 178.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.827 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.3 OUTLIER -67.92 155.89 38.41 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 171.339 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.464 ' HA ' ' ND2' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -52.24 105.7 0.12 Allowed 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 120.84 0.352 . . . . 0.0 111.148 -178.128 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.14 33.26 85.27 Favored Glycine 0 C--N 1.335 0.506 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.414 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.827 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 25.1 t-20 -126.08 100.9 6.54 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.904 0.383 . . . . 0.0 110.399 -176.249 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.45 77.56 9.21 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.085 0.469 . . . . 0.0 111.105 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.07 -55.62 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.91 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.6 m -88.66 129.59 35.48 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 176.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.643 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . . . -131.82 153.96 49.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.592 0.234 . . . . 0.0 110.423 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.695 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 0.8 OUTLIER -118.09 135.55 54.13 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.272 0.558 . . . . 0.0 111.201 -174.343 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.406 ' CB ' HD23 ' A' ' 81' ' ' LEU . . . -105.71 146.52 29.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.294 177.719 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.517 ' HE3' ' HG2' ' A' ' 100' ' ' GLU . 1.6 mppt? -102.36 168.33 9.39 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.36 -36.14 77.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.019 0.437 . . . . 0.0 110.809 178.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.612 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -62.85 -27.7 69.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.517 176.861 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.572 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 4.0 mp -82.21 -25.55 34.1 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.709 -178.566 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.23 -36.68 77.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.045 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -100.05 4.08 44.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.767 177.039 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.612 ' HB2' ' O ' ' A' ' 71' ' ' SER . 1.0 OUTLIER -94.92 -53.89 3.67 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.114 -178.783 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.574 ' HB3' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -123.89 -30.98 3.46 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.964 -175.522 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.94 50.76 3.19 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.02 -1.086 . . . . 0.0 112.0 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.438 ' CD1' ' HB3' ' A' ' 50' ' ' LEU . 3.7 mm? -57.44 113.08 1.62 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.754 0.312 . . . . 0.0 110.976 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -97.27 6.32 48.57 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.189 -177.896 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.72 ' HB1' ' HA ' ' A' ' 41' ' ' THR . . . -89.37 -40.84 12.48 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -175.699 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.747 HD21 HD11 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -99.21 -4.68 31.47 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.728 -171.749 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 2.8 t -108.86 137.94 38.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.875 0.369 . . . . 0.0 111.023 -174.356 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.716 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 27.7 t0 -120.29 174.42 6.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.108 179.204 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 27.1 p80 -60.11 140.51 56.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.115 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.483 ' HB ' HG22 ' A' ' 90' ' ' VAL . 5.3 t -143.14 160.68 39.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.852 -177.112 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -115.29 16.18 16.85 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.436 0.636 . . . . 0.0 109.71 176.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.44 ' HB3' ' H ' ' A' ' 88' ' ' GLY . 6.4 tm-20 -139.8 -93.48 0.17 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.42 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.534 ' O ' HG13 ' A' ' 90' ' ' VAL . . . -122.62 160.35 17.1 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 175.127 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.511 ' O ' HD12 ' A' ' 12' ' ' LEU . 51.3 Cg_exo -52.21 128.84 28.8 Favored 'Trans proline' 0 N--CA 1.474 0.326 0 C-N-CA 122.791 2.328 . . . . 0.0 112.259 -176.419 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 88' ' ' GLY . 29.0 m -125.16 159.72 31.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.946 -175.234 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.4 m -66.84 142.52 57.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.066 0.46 . . . . 0.0 111.227 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.716 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 2.0 tttp -75.43 -37.92 60.1 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.692 -176.515 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 12.1 m-20 -146.63 -72.13 0.23 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.27 -0.423 . . . . 0.0 112.015 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.42 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 74.7 mt -86.87 126.68 40.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.566 -171.34 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 27.4 m -92.93 128.91 44.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.404 174.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.509 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . . . -154.84 156.68 36.64 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.796 0.331 . . . . 0.0 111.097 -176.206 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.58 131.27 53.18 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 174.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.51 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 28.3 t -143.73 134.86 12.54 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.154 -172.382 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -85.26 155.8 10.97 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 122.488 2.126 . . . . 0.0 111.838 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.517 ' HG2' ' HE3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -100.55 127.63 46.86 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 176.221 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.726 ' H ' HD21 ' A' ' 56' ' ' LEU . . . 100.41 -7.7 58.3 Favored Glycine 0 N--CA 1.44 -1.077 0 C-N-CA 120.745 -0.74 . . . . 0.0 113.379 176.449 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.76 121.15 10.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -172.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.504 ' C ' ' HB2' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 41.52 -135.11 0.28 Allowed 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.876 1.435 . . . . 0.0 114.876 168.708 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.469 ' H ' ' HB ' ' A' ' 103' ' ' THR . 9.3 p30 -111.83 179.57 3.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.558 0.694 . . . . 0.0 112.599 -164.237 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.695 ' SG ' ' HB2' ' A' ' 67' ' ' CYS . 0.0 OUTLIER -118.47 154.98 31.6 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.735 -1.12 . . . . 0.0 111.052 -176.727 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.3 m -103.76 137.92 30.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.348 178.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -104.57 142.04 35.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.087 -176.09 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -122.62 20.6 4.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.294 0.568 . . . . 0.0 111.21 -178.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -90.32 21.14 3.99 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.86 -178.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -77.36 -5.67 50.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.331 -178.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -135.32 170.85 15.3 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.228 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -84.1 62.37 4.59 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.004 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -140.12 92.38 2.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.056 0.455 . . . . 0.0 111.196 -178.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -132.89 116.04 1.69 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.615 -0.802 . . . . 0.0 111.869 178.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.682 ' HB ' ' HB3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -86.07 59.8 5.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.825 0.312 . . . . 0.0 111.223 -176.615 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 115' ' ' THR . 0.0 OUTLIER -175.85 25.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.104 175.3 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 118' ' ' GLU . . . -84.86 78.72 9.84 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.274 -177.409 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' A' ' 117' ' ' ALA . 15.6 mt-10 . . . . . 0 C--O 1.25 1.11 0 O-C-N 124.041 0.838 . . . . 0.0 111.288 178.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.086 0 CA-C-O 120.966 0.412 . . . . 0.0 110.516 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' A' ' 2' ' ' LEU . 0.0 OUTLIER -113.36 143.73 29.88 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 177.793 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -62.49 99.28 0.2 Allowed 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.676 2.251 . . . . 0.0 112.131 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -112.48 -128.01 0.29 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.031 177.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.2 -56.3 3.52 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.762 0.315 . . . . 0.0 110.512 177.193 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -156.75 172.26 18.92 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.225 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -108.1 161.12 15.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.953 0.406 . . . . 0.0 111.036 -178.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.5 107.6 13.44 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.889 -177.812 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -100.42 8.29 43.69 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.525 -177.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -87.17 -19.95 27.7 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.426 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.4 mmtp -132.5 145.22 51.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.923 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.61 ' HG ' ' OG ' ' A' ' 15' ' ' SER . 0.1 OUTLIER -104.3 90.59 3.6 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.097 178.162 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.436 ' O ' ' HB ' ' A' ' 14' ' ' THR . . . 60.69 60.4 1.93 Allowed 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.551 177.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.436 ' HB ' ' O ' ' A' ' 13' ' ' ALA . 87.5 m 76.68 -48.9 0.56 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.412 -178.031 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.658 ' HB3' ' HB3' ' A' ' 18' ' ' PHE . 20.2 m 57.29 41.25 26.97 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.141 0.276 . . . . 0.0 111.108 179.167 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.574 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . -55.38 -50.14 70.49 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.771 0.319 . . . . 0.0 111.348 -173.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.84 ' HB1' ' HG3' ' A' ' 116' ' ' LYS . . . -93.61 -19.09 21.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.956 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.658 ' HB3' ' HB3' ' A' ' 15' ' ' SER . 19.9 t80 -70.13 -24.57 63.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.963 0.411 . . . . 0.0 110.089 177.721 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.96 -37.21 86.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.706 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.19 -33.4 71.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.519 0.676 . . . . 0.0 109.323 177.232 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.85 -39.05 80.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.475 176.645 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.43 -16.06 63.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.748 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -101.96 0.89 36.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.816 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.9 -32.43 63.65 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.913 -0.66 . . . . 0.0 111.94 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.04 158.89 44.07 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 177.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.52 95.3 1.78 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.214 0.531 . . . . 0.0 111.592 -176.514 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.1 m -148.24 150.36 33.55 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.123 176.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.44 -164.93 2.14 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 p -57.17 127.55 16.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.142 0.496 . . . . 0.0 110.5 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.537 ' O ' ' HA ' ' A' ' 99' ' ' PRO . . . 106.37 -30.46 9.53 Favored Glycine 0 N--CA 1.445 -0.743 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.177 -178.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.6 p -124.02 -11.17 7.61 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.6 tt -83.06 125.8 40.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.408 0.623 . . . . 0.0 110.751 -177.481 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.49 178.27 9.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.063 -179.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 12.2 m -125.8 137.84 53.8 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.221 173.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.493 ' C ' HD21 ' A' ' 81' ' ' LEU . 1.2 m -113.13 156.01 23.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.749 0.309 . . . . 0.0 110.824 -176.461 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.567 ' HB2' ' CD2' ' A' ' 81' ' ' LEU . 16.6 t-20 -141.52 159.39 42.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.959 0.409 . . . . 0.0 111.276 -177.021 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.78 138.52 95.37 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.998 175.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.557 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 11.9 Cg_endo -55.01 -34.61 87.61 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.006 2.471 . . . . 0.0 112.798 -175.076 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.8 -8.3 42.08 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.048 0.451 . . . . 0.0 111.61 -178.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -108.25 -50.28 3.06 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.849 HG22 HD21 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -61.57 -35.06 76.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.99 -1.004 . . . . 0.0 111.668 -179.658 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.557 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.7 m-80 -104.11 15.49 28.33 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.644 -172.02 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -58.91 -28.37 66.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.203 -177.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.935 ' HB3' ' HG ' ' A' ' 47' ' ' LEU . 15.0 t70 -122.52 146.16 47.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.191 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -22.33 62.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.815 -178.481 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.9 tp -90.38 -27.63 19.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.675 0.274 . . . . 0.0 110.299 178.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.935 ' HG ' ' HB3' ' A' ' 44' ' ' ASP . 19.2 mt -58.77 -40.6 84.4 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.643 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.87 -24.53 67.56 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.089 -178.056 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.55 -18.03 46.79 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.073 -0.584 . . . . 0.0 111.889 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.93 -18.14 48.13 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.166 0.508 . . . . 0.0 110.024 177.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.849 HD21 HG22 ' A' ' 41' ' ' THR . 0.1 OUTLIER -67.45 -43.19 81.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.696 176.847 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -104.16 86.85 0.53 Allowed Glycine 0 N--CA 1.442 -0.95 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.881 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.4 64.62 5.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.402 0.62 . . . . 0.0 109.559 174.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.36 -121.37 2.97 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 -175.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.659 ' HB3' HG23 ' A' ' 102' ' ' THR . 2.1 mt -111.92 47.59 1.04 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.069 0.462 . . . . 0.0 111.156 178.639 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.66 143.52 29.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.229 178.339 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -117.46 -177.56 3.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.711 -176.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -106.35 -142.42 10.84 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.599 -173.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.444 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -66.86 154.28 41.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.887 0.375 . . . . 0.0 111.14 -179.816 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.0 p -67.93 89.4 0.28 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.905 177.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.87 -45.07 1.47 Allowed Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 116.053 -0.522 . . . . 0.0 112.521 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.48 113.36 12.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.992 0.425 . . . . 0.0 111.064 -177.562 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.51 114.72 21.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.752 178.524 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 137.74 -53.08 0.73 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.754 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.53 136.58 44.08 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 176.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.513 ' HB3' HG21 ' A' ' 41' ' ' THR . . . -129.78 167.37 18.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.554 -178.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.463 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -125.43 130.14 51.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.188 178.5 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.407 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -105.34 136.23 45.27 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.795 0.331 . . . . 0.0 110.117 -178.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.457 ' HE2' ' HG3' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -100.99 155.73 17.81 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.094 -177.825 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.414 ' CB ' HD22 ' A' ' 12' ' ' LEU . . . -65.97 -23.61 66.63 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.122 -178.317 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -27.15 56.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.91 0.862 . . . . 0.0 109.17 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.6 -25.1 21.49 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.303 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.472 ' HA ' ' HB2' ' A' ' 78' ' ' LEU . 0.8 OUTLIER -63.2 -39.83 86.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.959 179.062 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -78.73 -2.99 42.01 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.17 0.51 . . . . 0.0 110.987 178.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.415 ' HB3' HD12 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -81.37 -39.16 25.45 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.724 -173.883 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.415 HD12 ' HB3' ' A' ' 75' ' ' GLN . 1.2 mp -143.84 14.81 1.73 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.707 -176.464 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.61 44.18 96.88 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.329 -0.939 . . . . 0.0 111.094 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.472 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 3.8 mp -53.47 126.41 21.36 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.183 -0.508 . . . . 0.0 111.143 -176.187 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.36 -1.8 11.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.772 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.702 ' HB2' HD22 ' A' ' 47' ' ' LEU . . . -79.78 -4.48 52.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.983 -174.617 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.567 ' CD2' ' HB2' ' A' ' 36' ' ' ASN . 0.3 OUTLIER -155.05 36.37 0.39 Allowed 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -172.955 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.15 137.96 37.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 120.999 0.428 . . . . 0.0 110.327 175.079 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.947 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 2.3 t0 -109.29 158.5 17.8 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 173.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -124.43 114.96 20.18 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 119.653 -0.819 . . . . 0.0 112.725 -170.628 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -107.95 -169.95 1.6 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.732 171.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -81.68 -7.62 59.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.72 0.295 . . . . 0.0 111.581 -175.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.574 ' HB3' ' HB3' ' A' ' 16' ' ' ALA . 0.3 OUTLIER -104.43 12.95 32.76 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 120.862 0.363 . . . . 0.0 110.782 -178.154 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 115.42 -166.43 12.22 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.602 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -80.07 136.05 11.41 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 123.369 2.713 . . . . 0.0 111.323 176.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.709 HG21 ' HE2' ' A' ' 116' ' ' LYS . 0.3 OUTLIER -140.29 -170.76 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.289 -175.251 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -66.49 132.0 47.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.09 0.472 . . . . 0.0 110.802 -177.603 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.947 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 6.3 tptp -74.7 -35.29 62.74 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.408 -175.572 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -155.34 -74.34 0.11 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.603 -175.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.6 mp -98.89 138.11 24.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.39 -172.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 25.7 t -97.28 118.47 43.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.945 178.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -144.03 160.67 40.47 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.745 0.307 . . . . 0.0 110.99 -176.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.13 124.8 50.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.497 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 45.9 t -136.0 117.85 11.89 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.971 -172.199 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.537 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 89.2 Cg_endo -76.14 138.27 20.18 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 122.863 2.375 . . . . 0.0 112.058 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.457 ' HG3' ' HE2' ' A' ' 69' ' ' LYS . 3.8 tt0 -85.91 139.33 31.33 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.54 176.568 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 128.62 -63.41 0.62 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.976 -0.63 . . . . 0.0 111.55 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.659 HG23 ' HB3' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -167.28 176.18 6.88 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 122.635 0.374 . . . . 0.0 110.196 178.378 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.537 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.7 OUTLIER 73.84 166.11 0.29 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.672 0.749 . . . . 0.0 112.158 177.407 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.537 ' H ' HG22 ' A' ' 103' ' ' THR . 21.5 m-20 -79.01 173.18 12.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.644 -1.162 . . . . 0.0 112.224 -174.129 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.497 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -113.27 142.94 45.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.744 175.381 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -102.91 142.01 17.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.066 0.46 . . . . 0.0 111.215 -175.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -106.86 122.84 47.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.339 177.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.33 17.59 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.931 -177.141 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -86.42 -42.98 13.17 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.834 -178.032 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 64.57 25.32 13.17 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.906 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 63.29 172.94 0.16 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.547 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -175.04 -116.44 0.44 Allowed Glycine 0 N--CA 1.443 -0.871 0 N-CA-C 110.794 -0.922 . . . . 0.0 110.794 176.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -160.15 -29.44 0.06 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.867 0.365 . . . . 0.0 111.037 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -86.82 134.78 12.75 Favored Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 178.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' A' ' 116' ' ' LYS . 0.7 OUTLIER -88.7 -43.93 10.95 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.952 0.406 . . . . 0.0 111.123 -176.948 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.84 ' HG3' ' HB1' ' A' ' 17' ' ' ALA . 0.0 OUTLIER 171.71 -25.63 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.596 -175.433 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -86.03 78.05 9.51 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.404 0.621 . . . . 0.0 111.089 -177.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 . . . . . 0 C--O 1.245 0.824 0 CA-C-O 118.266 -0.873 . . . . 0.0 108.804 175.674 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 120.564 0.221 . . . . 0.0 110.679 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.01 163.26 58.71 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.353 179.822 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.31 95.63 0.1 Allowed 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.899 2.4 . . . . 0.0 112.426 176.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -153.69 -119.79 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.881 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -27.98 63.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.15 0.5 . . . . 0.0 110.945 178.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.99 63.66 5.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.468 -178.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -123.41 25.23 8.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.581 176.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.5 mmpt? -117.01 117.19 28.96 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.789 -176.593 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 -113.01 13.96 19.56 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.531 -176.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -97.81 103.82 15.79 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.121 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.2 mmtt -128.61 -179.12 4.88 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.941 0.4 . . . . 0.0 110.548 -177.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.47 ' C ' ' H ' ' A' ' 14' ' ' THR . 3.8 mp -92.51 44.36 1.16 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.39 -179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 69.48 -13.63 0.37 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.716 0.806 . . . . 0.0 111.888 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.47 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -164.26 -55.3 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 177.705 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.508 ' HB2' ' H ' ' A' ' 16' ' ' ALA . 0.3 OUTLIER 56.7 -96.69 0.07 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.991 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.508 ' H ' ' HB2' ' A' ' 15' ' ' SER . . . 53.46 -91.97 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.66 0.6 . . . . 0.0 111.507 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.599 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . . . -53.85 -38.78 65.02 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.059 0.457 . . . . 0.0 110.871 174.468 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.713 ' HA ' ' HD2' ' A' ' 116' ' ' LYS . 65.5 t80 -73.5 -35.18 65.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.539 177.43 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 23' ' ' GLU . . . -65.16 -21.06 66.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.577 -174.459 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.599 ' HE3' ' HA ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -52.4 -24.43 7.73 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.943 0.401 . . . . 0.0 111.115 177.033 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.497 ' HG3' ' HE3' ' A' ' 116' ' ' LYS . 1.0 OUTLIER -64.93 -31.49 72.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.918 179.088 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.46 -17.25 27.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.21 -176.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.506 ' HG3' ' HA ' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -97.26 -45.31 6.55 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.871 -179.26 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.57 -37.07 21.42 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.377 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.94 153.43 28.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.871 0.367 . . . . 0.0 111.025 -177.497 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.66 98.35 11.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.999 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.2 m -135.5 170.8 15.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.746 176.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.418 ' H ' ' HB2' ' A' ' 31' ' ' SER . 2.2 t-20 -111.16 164.83 12.45 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.053 -173.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -61.06 -35.52 65.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.243 -178.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -107.14 35.97 4.69 Favored Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 176.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.756 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 15.6 m -145.84 -9.29 0.54 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.409 -0.395 . . . . 0.0 111.263 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -81.18 126.11 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.034 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.12 -179.33 6.95 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.336 0.589 . . . . 0.0 112.061 -169.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.433 ' O ' HD13 ' A' ' 81' ' ' LEU . 7.8 t -136.86 141.07 42.78 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.124 172.508 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -122.61 151.66 41.23 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.082 -178.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -135.71 157.05 47.81 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.66 135.54 7.8 Favored Pre-proline 0 C--N 1.33 -0.252 0 O-C-N 124.05 0.843 . . . . 0.0 110.922 177.561 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -49.91 -38.68 48.78 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.589 2.859 . . . . 0.0 113.609 -174.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.45 -8.86 54.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.973 0.416 . . . . 0.0 111.663 -177.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -109.13 -35.37 6.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.143 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -42.22 81.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.611 0.72 . . . . 0.0 110.259 175.692 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -95.27 15.46 19.22 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.531 -178.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -58.72 -32.3 69.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.886 178.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.993 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 24.7 t70 -108.4 136.1 48.6 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.672 174.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -25.28 65.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.733 0.301 . . . . 0.0 111.573 -176.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.3 tp -91.78 -22.85 19.94 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.956 178.079 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.993 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.1 OUTLIER -55.92 -46.45 78.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.273 -178.362 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.568 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -61.8 -24.2 66.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.039 0.447 . . . . 0.0 111.358 -179.261 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -96.03 -5.89 59.37 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.579 -0.819 . . . . 0.0 111.74 177.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.806 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 1.3 tp -83.96 -33.52 24.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.826 0.346 . . . . 0.0 110.194 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.568 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.3 OUTLIER -73.86 -32.54 63.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.362 178.334 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.659 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -84.9 69.04 3.39 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.551 -0.833 . . . . 0.0 111.996 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.27 55.46 2.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.419 0.628 . . . . 0.0 109.812 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 141.27 -112.42 0.77 Allowed Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.611 -0.996 . . . . 0.0 110.611 -175.158 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.72 60.29 1.03 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.159 0.504 . . . . 0.0 110.215 175.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.659 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 0.2 OUTLIER -87.08 142.13 28.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.165 178.768 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.564 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 1.0 OUTLIER -111.59 -178.0 3.33 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.382 -176.742 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -109.84 -155.12 15.34 Favored Glycine 0 C--O 1.227 -0.305 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.148 -175.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.483 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -65.7 146.45 54.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.794 0.33 . . . . 0.0 110.64 176.838 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.9 m -66.09 93.15 0.19 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.778 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 109.83 -58.87 0.37 Allowed Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.868 -178.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -71.71 99.43 2.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.034 0.445 . . . . 0.0 110.615 -179.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.73 70.27 8.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.394 0.616 . . . . 0.0 110.586 179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -166.72 -54.47 0.03 OUTLIER Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.536 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.69 120.28 14.43 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 175.222 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.507 ' HB1' HD13 ' A' ' 51' ' ' LEU . . . -115.74 142.16 47.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.559 -178.436 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.497 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 1.0 OUTLIER -110.98 128.95 56.01 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.593 -178.407 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 1.036 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -111.63 140.5 46.2 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.013 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.719 ' HD2' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -94.69 174.65 7.0 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.32 -174.733 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.26 -31.36 71.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.104 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.474 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.9 OUTLIER -67.13 -36.31 81.62 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.702 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.527 HD13 ' HA ' ' A' ' 72' ' ' LEU . 0.1 OUTLIER -75.24 -36.16 61.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.494 178.788 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.8 mt -61.51 -41.73 91.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.295 0.569 . . . . 0.0 109.641 175.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -77.22 -7.36 55.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.001 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' A' ' 71' ' ' SER . 2.0 tp-100 -95.03 -54.35 3.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.873 -177.067 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.806 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -122.87 -6.4 8.49 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -173.148 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 65.79 49.74 57.46 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.546 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.4 mp -70.95 97.5 1.44 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.735 0.302 . . . . 0.0 111.516 -176.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.911 ' HA ' HG12 ' A' ' 82' ' ' VAL . 0.0 OUTLIER -86.86 18.51 3.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.932 0.396 . . . . 0.0 111.323 179.743 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.4 -26.36 35.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.895 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 1.036 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.1 OUTLIER -126.03 -4.34 6.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.647 -178.309 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.911 HG12 ' HA ' ' A' ' 79' ' ' LEU . 1.9 p -104.68 141.33 20.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.21 0.529 . . . . 0.0 110.704 -177.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -129.37 174.92 9.18 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.465 177.009 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -133.67 107.76 8.14 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.951 0.405 . . . . 0.0 111.049 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.498 ' C ' ' H ' ' A' ' 87' ' ' GLU . 17.5 p -79.97 -168.82 1.76 Allowed 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 173.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -75.9 28.02 0.11 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.165 0.507 . . . . 0.0 110.403 173.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.498 ' H ' ' C ' ' A' ' 85' ' ' THR . 1.4 mm-40 -126.39 -101.32 0.37 Allowed 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.501 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -135.58 -158.83 8.36 Favored Glycine 0 N--CA 1.445 -0.71 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 178.28 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -69.01 117.84 5.29 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.552 2.168 . . . . 0.0 111.12 176.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.512 HG12 ' HB2' ' A' ' 18' ' ' PHE . 2.5 m -129.14 170.89 17.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.174 0.511 . . . . 0.0 111.74 -173.62 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.504 ' HB2' ' HE2' ' A' ' 116' ' ' LYS . 2.4 t -67.82 118.86 11.62 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.167 177.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 35.7 tttp -69.27 -30.15 68.2 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.114 -178.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.417 ' HB3' ' H ' ' A' ' 94' ' ' ILE . 0.6 OUTLIER -152.29 -105.84 0.05 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.142 0.496 . . . . 0.0 111.989 -173.407 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.443 HG23 ' HB3' ' A' ' 109' ' ' ASP . 3.7 mt -76.61 126.6 37.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.781 -168.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -91.7 132.22 36.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 175.643 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.497 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . . . -152.87 158.91 42.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.969 -176.304 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -105.85 116.71 32.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.966 0.412 . . . . 0.0 110.01 179.646 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.756 ' O ' ' HA ' ' A' ' 31' ' ' SER . 5.6 t -129.5 117.31 18.64 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.083 -173.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -73.71 146.1 37.9 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 122.648 2.232 . . . . 0.0 112.748 -178.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.3 129.11 35.9 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 173.272 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 130.09 -60.89 0.67 Allowed Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.792 -0.718 . . . . 0.0 111.91 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -169.36 174.79 5.85 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 122.917 0.487 . . . . 0.0 109.949 176.275 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 17.2 m 79.42 144.86 0.08 Allowed 'General case' 0 N--CA 1.462 0.159 0 O-C-N 124.043 0.84 . . . . 0.0 111.942 176.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.564 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -70.67 176.02 4.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.491 -1.231 . . . . 0.0 111.185 -178.049 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.471 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -110.96 141.96 43.7 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.898 -176.151 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 3.3 m -88.07 145.75 7.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.289 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.92 121.45 45.27 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.891 0.377 . . . . 0.0 111.084 -177.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.28 30.52 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.564 177.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.443 ' HB3' HG23 ' A' ' 94' ' ' ILE . 34.3 p-10 -76.04 -11.48 59.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.409 -175.224 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.54 -53.34 53.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.174 0.512 . . . . 0.0 111.314 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -97.94 47.12 1.01 Allowed 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.799 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -148.38 64.29 0.41 Allowed Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.769 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -78.9 65.76 4.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.049 0.452 . . . . 0.0 111.036 -176.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 147.4 85.84 0.06 OUTLIER Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.982 -0.628 . . . . 0.0 111.684 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 12.2 t -75.75 118.31 18.43 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.261 0.553 . . . . 0.0 111.16 -176.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.713 ' HD2' ' HA ' ' A' ' 18' ' ' PHE . 0.8 OUTLIER 58.55 42.36 20.94 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.034 176.353 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -118.76 144.68 46.12 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.394 -176.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 . . . . . 0 C--O 1.247 0.942 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 176.416 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 11.2 m . . . . . 0 N--CA 1.476 0.874 0 CA-C-O 120.692 0.282 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.478 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.1 OUTLIER -73.44 140.31 79.02 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.676 178.884 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 2' ' ' LEU . 8.3 Cg_exo -75.04 -179.37 4.93 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 123.137 2.558 . . . . 0.0 112.297 178.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 66.67 -70.17 0.11 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.529 0.732 . . . . 0.0 112.019 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.37 144.39 46.47 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.458 -179.012 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.2 65.68 3.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.357 0.599 . . . . 0.0 110.607 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.1 -0.57 22.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.872 -176.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.9 mmtt -84.77 -1.17 55.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.239 0.543 . . . . 0.0 110.383 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -91.86 -22.07 20.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.324 178.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.2 95.38 0.99 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.172 -177.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.484 ' HD2' ' HG2' ' A' ' 89' ' ' PRO . 0.5 OUTLIER -112.78 -93.36 0.47 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.065 179.119 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 65.0 6.87 3.66 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.696 0.622 . . . . 0.0 110.834 -176.516 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.14 -32.88 5.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.31 0.576 . . . . 0.0 110.221 178.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.29 -22.02 45.21 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.895 178.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.11 76.23 6.86 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.599 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.8 -28.36 65.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.315 0.579 . . . . 0.0 110.076 175.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.921 ' HB1' ' HB2' ' A' ' 116' ' ' LYS . . . -64.64 -33.44 75.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.397 177.032 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -72.67 -30.88 64.64 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.51 -38.28 86.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.939 174.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' A' ' 17' ' ' ALA . 1.4 mtpp -69.97 -36.88 75.55 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.688 0.756 . . . . 0.0 109.072 175.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.91 -25.24 68.06 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.787 176.396 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.459 ' HA ' HD11 ' A' ' 32' ' ' ILE . . . -68.61 -14.96 63.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.45 . . . . 0.0 112.019 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -110.6 9.4 23.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.096 0.474 . . . . 0.0 110.383 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.28 -12.5 73.15 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 175.062 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.3 m -151.83 139.97 20.24 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 176.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.73 97.29 1.06 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.639 0.257 . . . . 0.0 110.97 -179.109 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.8 m -149.21 165.59 31.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.123 -177.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.533 ' O ' ' HB ' ' A' ' 32' ' ' ILE . 21.2 m120 -115.83 174.7 5.89 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.624 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 t -55.6 -42.99 71.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -178.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.24 9.43 72.22 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.423 -0.894 . . . . 0.0 113.131 -176.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.498 ' OG ' ' HB2' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -131.57 2.71 4.15 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.139 0.495 . . . . 0.0 110.958 -179.82 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.533 ' HB ' ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -89.8 132.7 33.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.577 -179.484 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.705 ' HB2' ' HD2' ' A' ' 69' ' ' LYS . . . -145.07 156.16 43.75 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.485 0.659 . . . . 0.0 111.791 -175.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.3 t -108.64 130.85 55.32 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 115.107 -0.951 . . . . 0.0 108.514 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.643 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 60.1 m -116.68 154.43 30.6 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -178.242 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.63 ' OD1' ' HB ' ' A' ' 41' ' ' THR . 12.7 p30 -152.3 159.19 43.53 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.519 177.527 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.433 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.9 OUTLIER -54.88 133.42 66.7 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.733 176.633 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.709 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 54.8 Cg_exo -49.86 -31.42 26.53 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.557 2.838 . . . . 0.0 113.607 -172.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.25 -19.93 49.92 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -177.012 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.96 -53.18 3.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.772 -177.438 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.63 ' HB ' ' OD1' ' A' ' 36' ' ' ASN . 0.4 OUTLIER -69.4 -25.07 63.96 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.541 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.709 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 2.1 m120 -91.98 15.78 12.5 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.041 -177.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -49.4 -33.73 14.56 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.894 -179.175 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.782 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 6.2 t70 -119.3 152.35 36.87 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.678 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.0 -24.32 40.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.396 -175.357 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 tp -85.36 -36.28 20.85 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 175.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.782 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -52.3 -39.88 61.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.542 175.983 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.06 -18.25 65.14 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.145 -177.206 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -97.32 -25.88 10.63 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.065 -0.588 . . . . 0.0 111.837 176.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 94.2 mt -75.68 -9.04 58.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.771 0.319 . . . . 0.0 110.778 179.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.461 HD21 HG23 ' A' ' 41' ' ' THR . 0.1 OUTLIER -65.81 -13.53 59.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.007 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.433 ' HA3' ' HB2' ' A' ' 56' ' ' LEU . . . -148.91 94.05 0.15 Allowed Glycine 0 N--CA 1.444 -0.815 0 N-CA-C 111.228 -0.749 . . . . 0.0 111.228 176.673 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.466 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -81.42 63.46 5.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.02 0.438 . . . . 0.0 111.459 -171.648 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 154.49 52.94 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.546 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 60.75 43.69 11.95 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.919 0.39 . . . . 0.0 111.619 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.727 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 0.1 OUTLIER -85.95 -174.36 5.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.935 0.398 . . . . 0.0 111.084 179.712 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.525 ' H ' HD23 ' A' ' 56' ' ' LEU . 10.5 t-20 -132.88 -178.28 4.88 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.201 -178.478 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.545 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -107.42 -146.3 12.73 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.717 -0.674 . . . . 0.0 112.156 -177.282 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 12.9 tp -65.69 145.96 55.38 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.0 t -53.93 109.77 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.842 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.29 -51.08 4.44 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.81 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 24.6 t30 -81.32 94.35 6.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.307 0.575 . . . . 0.0 111.172 -176.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.73 129.08 38.68 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.324 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 131.95 -51.17 0.86 Allowed Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.793 178.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.89 68.82 7.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.878 0.371 . . . . 0.0 110.95 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.545 ' HA ' ' HA2' ' A' ' 58' ' ' GLY . . . -79.95 137.77 36.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.745 176.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.3 m -110.83 141.51 44.09 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.109 0.48 . . . . 0.0 111.774 -174.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.905 ' HB3' HD22 ' A' ' 81' ' ' LEU . . . -104.76 156.16 18.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.905 178.165 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.705 ' HD2' ' HB2' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -111.7 -178.42 3.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.201 -172.939 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.61 -37.96 83.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.695 0.283 . . . . 0.0 111.342 -177.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -41.39 94.9 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.473 0.654 . . . . 0.0 110.103 177.583 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.472 ' HB3' ' HB1' ' A' ' 68' ' ' ALA . 1.1 mp -72.57 -17.08 61.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.162 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -66.03 -34.09 67.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 173.575 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -101.01 -39.33 7.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.55 -174.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.8 -29.68 20.08 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -174.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.482 HD13 ' HA ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -147.14 -17.82 0.4 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 111.871 0.322 . . . . 0.0 111.871 -178.479 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.41 51.96 5.01 Favored Glycine 0 CA--C 1.519 0.304 0 C-N-CA 119.935 -1.126 . . . . 0.0 112.406 178.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.02 84.62 0.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.107 0.479 . . . . 0.0 111.018 -178.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.451 ' HG ' ' H ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -69.55 -6.24 29.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.565 -174.693 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -77.72 -16.49 58.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.825 0.345 . . . . 0.0 110.735 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.905 HD22 ' HB3' ' A' ' 68' ' ' ALA . 0.4 OUTLIER -105.54 -25.09 12.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.517 -175.907 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.44 138.85 24.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.0 0.428 . . . . 0.0 111.007 -177.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.454 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 5.8 t70 -117.85 159.26 23.37 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 174.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.508 ' CE1' ' HA2' ' A' ' 88' ' ' GLY . 23.8 t-80 -111.58 110.91 21.56 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.204 0.526 . . . . 0.0 110.858 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.3 p -97.07 -167.81 1.6 Allowed 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.093 177.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.435 ' HG3' ' H ' ' A' ' 86' ' ' GLU . 16.6 mt-10 -51.12 -44.06 61.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.531 177.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.413 ' CD ' ' HB2' ' A' ' 17' ' ' ALA . 48.9 mp0 -72.83 -75.42 0.14 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.842 0.353 . . . . 0.0 111.148 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.508 ' HA2' ' CE1' ' A' ' 84' ' ' HIS . . . -168.65 -151.48 7.18 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.617 -176.159 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.484 ' HG2' ' HD2' ' A' ' 11' ' ' LYS . 13.4 Cg_exo -69.82 107.9 1.97 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 123.128 2.552 . . . . 0.0 111.703 178.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.468 HG11 ' HB3' ' A' ' 17' ' ' ALA . 1.0 OUTLIER -125.61 -173.3 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.014 -176.726 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 50.1 t -67.72 134.13 50.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.41 177.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.454 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttt -73.65 -36.04 65.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.792 -178.088 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.522 ' HB3' HG13 ' A' ' 94' ' ' ILE . 4.8 m-80 -146.66 -95.22 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -171.102 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.522 HG13 ' HB3' ' A' ' 93' ' ' ASN . 3.5 mt -93.57 132.86 36.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.888 -168.701 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.49 130.82 36.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.501 177.03 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.643 ' HB3' ' SG ' ' A' ' 35' ' ' CYS . . . -154.52 175.8 13.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.051 0.453 . . . . 0.0 111.476 -178.53 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.97 125.69 54.68 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.555 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.621 ' HB3' ' HD2' ' A' ' 69' ' ' LYS . 15.3 t -144.22 129.01 9.38 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.18 -176.634 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.469 ' O ' HD21 ' A' ' 56' ' ' LEU . 67.5 Cg_endo -87.86 129.83 2.56 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 122.95 2.433 . . . . 0.0 112.818 -176.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.687 ' HG2' ' HE2' ' A' ' 69' ' ' LYS . 4.7 mm-40 -77.31 97.28 4.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.109 0.48 . . . . 0.0 110.691 176.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.463 ' O ' ' HB ' ' A' ' 102' ' ' THR . . . 169.67 -53.01 0.2 Allowed Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 177.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.727 ' HA ' ' HA ' ' A' ' 56' ' ' LEU . 5.8 t 177.07 -176.33 0.14 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.634 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 71.95 158.96 0.2 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.343 0.592 . . . . 0.0 111.099 -176.487 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.497 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 1.0 OUTLIER -76.17 173.88 10.79 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.498 -175.755 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.5 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -111.25 150.65 29.3 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.931 -179.467 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.467 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 6.0 m -106.6 133.48 51.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.891 0.377 . . . . 0.0 110.64 -177.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.98 119.55 39.67 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.316 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -114.28 13.44 8.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.062 0.458 . . . . 0.0 110.765 -178.224 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.17 122.3 19.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.312 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -130.68 81.43 2.0 Allowed 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.228 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 66.3 40.16 3.83 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.338 -177.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -116.31 -28.41 2.6 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.933 176.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.17 151.35 47.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.052 0.453 . . . . 0.0 111.363 178.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 119.54 -14.2 10.8 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.315 -179.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.4 t -137.82 170.06 16.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.904 0.383 . . . . 0.0 110.572 178.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.921 ' HB2' ' HB1' ' A' ' 17' ' ' ALA . 0.0 OUTLIER -128.79 -32.73 2.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.289 0.566 . . . . 0.0 110.182 179.817 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -120.69 139.85 52.46 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.751 -0.658 . . . . 0.0 109.894 177.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.443 -0.789 . . . . 0.0 109.977 178.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 CA-C-O 120.416 0.15 . . . . 0.0 110.857 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 mm? 53.31 74.13 0.82 Allowed Pre-proline 0 CA--C 1.531 0.248 0 O-C-N 123.906 0.754 . . . . 0.0 112.381 176.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -82.79 24.45 0.74 Allowed 'Trans proline' 0 CA--C 1.528 0.217 0 C-N-CA 122.967 2.445 . . . . 0.0 112.546 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.72 -33.0 74.86 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.329 -175.1 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.91 -7.6 59.53 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.313 179.607 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.51 3.08 45.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.041 0.448 . . . . 0.0 110.801 -179.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.59 143.8 54.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.903 179.259 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -149.6 127.08 11.54 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.293 0.568 . . . . 0.0 110.49 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.421 ' HB3' ' H ' ' A' ' 10' ' ' ALA . 21.5 m120 -113.72 -151.01 0.47 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.104 -178.661 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.421 ' H ' ' HB3' ' A' ' 9' ' ' ASN . . . -86.54 68.79 10.28 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.038 -178.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.09 150.86 27.96 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.186 176.147 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.468 ' HA ' HD22 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -78.75 -27.78 44.79 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.314 174.312 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.68 -28.72 69.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.629 -179.103 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.06 -27.06 61.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.184 0.516 . . . . 0.0 111.074 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -88.22 68.17 8.94 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.448 -176.401 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.51 -31.47 69.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.6 -29.45 70.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.934 174.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.584 ' HB2' HG12 ' A' ' 90' ' ' VAL . 69.9 t80 -84.47 -29.62 25.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.974 0.416 . . . . 0.0 110.466 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.43 -4.46 22.65 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.975 -178.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.47 -24.78 31.64 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 176.324 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.542 ' HG2' HG21 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -73.32 -27.34 61.47 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.858 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.12 -11.27 60.77 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.846 178.325 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -101.8 -47.54 4.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.103 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -72.08 -44.87 43.66 Favored Glycine 0 C--N 1.33 0.199 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.8 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.36 136.4 32.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.742 0.306 . . . . 0.0 110.918 -178.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.74 96.0 7.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.882 0.372 . . . . 0.0 111.618 -177.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.428 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 98.9 m -144.47 -178.85 6.19 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 176.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 31.8 t30 -102.66 134.78 45.46 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.4 p -62.57 -29.27 46.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 O-C-N 123.214 0.321 . . . . 0.0 111.334 -177.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -88.84 8.35 79.77 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.734 -0.746 . . . . 0.0 111.754 177.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.3 m -149.63 42.94 0.91 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.084 0.468 . . . . 0.0 110.408 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -97.65 140.14 18.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 176.397 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.479 ' CB ' ' HB3' ' A' ' 98' ' ' CYS . . . -148.67 160.88 42.73 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 121.194 0.521 . . . . 0.0 111.717 -173.419 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 21.5 m -114.6 131.98 56.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.158 173.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.429 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 2.8 m -122.23 164.94 16.98 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.297 -178.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.573 ' HB2' HD12 ' A' ' 81' ' ' LEU . 1.1 t30 -147.42 159.91 43.17 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.258 -179.571 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.05 142.1 37.1 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.786 175.103 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.508 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 83.9 Cg_exo -47.6 -44.84 24.99 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.858 3.038 . . . . 0.0 114.73 -173.079 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.47 -15.32 62.53 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -173.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.569 ' CD ' ' HZ1' ' A' ' 92' ' ' LYS . 4.7 mt-10 -98.59 -48.52 4.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.539 0.685 . . . . 0.0 109.631 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.416 HG22 HD22 ' A' ' 51' ' ' LEU . 3.6 m -61.13 -34.6 75.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.11 177.238 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.508 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.1 m-80 -104.93 15.2 28.17 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.779 -177.592 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -53.83 -40.16 66.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.481 -177.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 1.095 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.1 t70 -102.66 146.93 27.46 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.74 -179.343 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -34.19 77.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.86 -177.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 46' ' ' LEU . 6.3 tp -92.28 -24.29 19.02 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.089 0.471 . . . . 0.0 110.736 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 1.095 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -58.85 -31.76 68.82 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.515 -177.613 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.44 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -63.01 -11.76 21.28 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -176.537 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -117.42 -21.49 4.37 Favored Glycine 0 C--N 1.331 0.301 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 172.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.2 mp -84.3 -7.21 59.4 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.708 ' HA ' ' HG ' ' A' ' 78' ' ' LEU . 0.3 OUTLIER -70.55 -9.0 55.7 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.301 0.572 . . . . 0.0 109.975 179.08 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.637 ' HA2' HD23 ' A' ' 72' ' ' LEU . . . -128.44 -125.99 2.82 Favored Glycine 0 N--CA 1.438 -1.224 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 176.151 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -168.76 -24.6 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.358 0.599 . . . . 0.0 109.669 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -126.1 -157.98 9.76 Favored Glycine 0 N--CA 1.443 -0.878 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 172.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.459 ' O ' HG22 ' A' ' 102' ' ' THR . 0.2 OUTLIER -75.53 64.79 1.67 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.182 0.515 . . . . 0.0 110.927 179.761 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.701 ' HA ' ' O ' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -65.55 150.62 48.1 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.778 178.294 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -109.22 177.89 4.62 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 171.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -110.18 -154.18 14.38 Favored Glycine 0 CA--C 1.504 -0.603 0 C-N-CA 120.361 -0.923 . . . . 0.0 111.993 -173.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.683 ' HB3' ' HB2' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -65.46 139.54 58.52 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 178.37 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.2 m -56.77 96.48 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.5 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.11 19.12 56.46 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.883 178.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.683 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 1.1 t-20 -127.92 95.03 4.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.182 0.515 . . . . 0.0 109.92 178.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.33 88.4 3.14 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.612 -176.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 153.96 -43.74 0.6 Allowed Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.968 -0.634 . . . . 0.0 111.798 176.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.6 98.94 7.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.947 0.404 . . . . 0.0 110.675 179.007 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.51 171.58 9.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.982 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 79.4 m -134.68 140.08 45.73 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.273 -175.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -104.81 124.73 49.94 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.51 ' HG2' ' H ' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -85.19 157.17 20.71 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.259 -175.465 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.84 -36.31 72.11 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 m -63.55 -31.91 73.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.191 0.52 . . . . 0.0 110.44 176.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.714 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 0.3 OUTLIER -85.88 -18.82 31.72 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.897 -177.57 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.77 -37.98 81.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 172.115 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -79.8 -6.84 58.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.667 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.799 ' HB3' HD12 ' A' ' 76' ' ' LEU . 4.0 tp60 -95.1 -42.3 8.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.245 -178.137 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.799 HD12 ' HB3' ' A' ' 75' ' ' GLN . 4.2 mp -134.79 -65.52 0.63 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.767 -177.437 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.58 50.27 1.86 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.35 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.708 ' HG ' ' HA ' ' A' ' 51' ' ' LEU . 1.8 mm? -59.66 107.03 0.54 Allowed 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 122.613 0.365 . . . . 0.0 110.797 -178.571 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.435 ' HG ' ' H ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.58 17.1 0.16 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.428 -171.941 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -93.13 -29.23 15.87 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.225 0.536 . . . . 0.0 109.659 173.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.573 HD12 ' HB2' ' A' ' 36' ' ' ASN . 0.5 OUTLIER -105.11 -1.7 25.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.664 -173.016 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.489 ' C ' ' HG2' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -123.6 137.61 56.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.292 0.568 . . . . 0.0 111.295 -178.955 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -90.19 174.06 7.82 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 173.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.7 72.28 1.4 Allowed 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 122.039 0.923 . . . . 0.0 110.508 -176.157 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.514 HG21 ' HE3' ' A' ' 116' ' ' LYS . 98.0 m -72.76 158.57 35.32 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 114.099 -1.409 . . . . 0.0 109.665 175.78 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -53.43 -35.59 60.62 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -177.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.03 -63.82 1.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.468 0.652 . . . . 0.0 110.327 177.379 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -173.37 -174.56 40.49 Favored Glycine 0 N--CA 1.44 -1.072 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -69.96 132.34 22.81 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.032 1.821 . . . . 0.0 110.846 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.584 HG12 ' HB2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -133.57 -178.53 2.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.934 -169.411 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.43 133.7 50.04 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.256 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.569 ' HZ1' ' CD ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -71.67 -46.84 57.66 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 -177.074 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -150.68 -70.54 0.18 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.837 -171.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.416 ' HB ' ' HB2' ' A' ' 35' ' ' CYS . 15.7 mt -98.88 120.91 48.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.183 -174.0 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.542 HG21 ' HG2' ' A' ' 21' ' ' GLN . 7.6 p -93.51 129.96 43.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.125 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.429 ' HB3' ' SG ' ' A' ' 35' ' ' CYS . . . -148.81 169.72 19.84 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.398 0.618 . . . . 0.0 111.561 -174.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.428 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -105.16 115.97 31.17 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.217 175.561 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.491 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 38.9 t -136.38 126.3 16.08 Favored Pre-proline 0 C--N 1.319 -0.723 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.87 -173.4 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -67.21 134.38 33.61 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.721 2.281 . . . . 0.0 111.462 178.004 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.451 ' HA ' ' HG3' ' A' ' 69' ' ' LYS . 1.3 tt0 -67.03 118.23 10.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.106 0.479 . . . . 0.0 109.894 176.65 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.701 ' O ' ' HA ' ' A' ' 56' ' ' LEU . . . 113.9 -115.93 3.73 Favored Glycine 0 N--CA 1.437 -1.296 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -176.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.459 HG22 ' O ' ' A' ' 55' ' ' LEU . 66.8 p -98.83 -174.84 2.89 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 123.659 0.27 . . . . 0.0 110.802 -173.071 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.1 m 74.07 151.67 0.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.686 0.755 . . . . 0.0 112.058 177.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -76.34 159.77 30.22 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.027 -175.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.491 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.4 141.41 46.17 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.893 -179.75 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.42 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 1.7 m -99.37 135.2 35.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.164 0.507 . . . . 0.0 111.185 -178.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -100.52 112.01 24.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.537 176.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 1.8 m -94.45 21.71 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -170.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -118.9 133.85 55.56 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.34 0.59 . . . . 0.0 111.108 177.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -151.7 25.6 0.66 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.888 -1.051 . . . . 0.0 108.582 173.034 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -133.45 -36.27 0.98 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.611 -175.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 77.53 80.0 0.69 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.778 -0.725 . . . . 0.0 111.866 -177.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -86.79 -43.53 12.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.151 0.501 . . . . 0.0 111.673 -177.19 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -164.8 -171.22 30.78 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.691 -178.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -107.43 -60.0 1.75 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.975 0.417 . . . . 0.0 111.123 -178.163 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.514 ' HE3' HG21 ' A' ' 85' ' ' THR . 0.0 OUTLIER -154.72 -79.35 0.09 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 175.474 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -95.2 77.9 3.48 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 171.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 . . . . . 0 C--O 1.256 1.435 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.668 -173.247 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.492 ' C ' ' H ' ' A' ' 14' ' ' THR . 7.8 mp . . . . . 0 C--O 1.234 0.283 0 CA-C-O 120.193 0.044 . . . . 0.0 110.905 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 68.96 -33.4 0.24 Allowed 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.362 0.665 . . . . 0.0 111.536 -177.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.492 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -153.62 -51.36 0.1 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.066 178.146 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.417 ' HG ' ' N ' ' A' ' 12' ' ' LEU . 26.4 m 66.73 -78.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.813 -177.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 52.23 -87.71 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.636 0.585 . . . . 0.0 110.964 -177.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.01 84.62 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.63 174.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -69.18 -25.75 64.5 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.044 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.59 -40.28 66.69 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.942 175.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.83 -35.72 80.84 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 174.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.47 -46.9 88.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.211 174.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.83 -18.28 64.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.739 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.08 -33.92 13.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.87 178.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.66 -24.4 58.5 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.3 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.71 133.47 52.75 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.801 0.334 . . . . 0.0 110.345 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.33 96.55 4.64 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.104 0.478 . . . . 0.0 111.383 -178.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.4 m -142.04 -177.78 5.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.057 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -117.2 157.34 26.17 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.288 -179.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.419 HG22 ' H ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -68.36 -48.54 72.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -173.555 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.37 9.37 61.58 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.812 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 m -139.57 31.4 2.08 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.164 0.507 . . . . 0.0 110.034 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -90.54 127.93 42.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.383 -179.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.88 169.11 21.27 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.085 0.469 . . . . 0.0 111.474 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.432 ' O ' HD22 ' A' ' 81' ' ' LEU . 8.8 t -125.72 140.12 52.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.194 172.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.605 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 0.3 OUTLIER -121.91 138.99 54.19 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.639 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.492 HD22 ' HB2' ' A' ' 40' ' ' GLU . 10.1 t30 -116.16 160.18 20.73 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.77 -179.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.91 126.92 3.22 Favored Pre-proline 0 C--O 1.237 0.443 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.111 172.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.46 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 7.9 Cg_endo -49.69 -38.74 46.74 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.909 3.072 . . . . 0.0 114.198 -171.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.74 -23.96 66.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.758 0.313 . . . . 0.0 111.666 -175.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.492 ' HB2' HD22 ' A' ' 36' ' ' ASN . 51.2 mm-40 -96.49 -41.76 8.42 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 0.0 110.27 -178.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.451 ' HA ' ' HB1' ' A' ' 80' ' ' ALA . 2.0 m -62.44 -33.65 75.24 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.447 0.641 . . . . 0.0 110.468 175.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.6 OUTLIER -104.13 16.01 27.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.5 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -52.97 -48.58 67.31 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.212 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 1.001 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 7.4 t70 -94.53 136.12 35.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.885 175.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -27.44 67.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.103 0.478 . . . . 0.0 110.493 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.01 -26.4 29.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.251 178.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 1.001 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -60.13 -37.06 78.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.331 178.39 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.32 -34.07 70.19 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.09 179.043 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -94.11 -12.91 55.83 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.104 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -77.01 -33.98 57.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.022 0.439 . . . . 0.0 110.664 -178.217 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.453 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.6 OUTLIER -73.43 -30.22 63.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.151 0.5 . . . . 0.0 110.748 179.162 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.664 ' HA2' ' HG ' ' A' ' 56' ' ' LEU . . . -91.31 60.44 2.97 Favored Glycine 0 N--CA 1.443 -0.898 0 C-N-CA 121.058 -0.592 . . . . 0.0 112.429 -177.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.81 -24.86 67.92 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.91 0.386 . . . . 0.0 111.034 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -118.12 22.71 9.59 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.542 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.592 ' O ' HG23 ' A' ' 102' ' ' THR . 21.4 tp 66.27 44.18 2.57 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.162 0.506 . . . . 0.0 110.624 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.664 ' HG ' ' HA2' ' A' ' 52' ' ' GLY . 0.2 OUTLIER -86.07 178.28 7.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.091 -177.648 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -120.06 -176.08 3.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.744 -175.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -100.92 -154.36 26.81 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.295 -174.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.573 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 8.2 tp -66.68 140.38 57.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.831 0.316 . . . . 0.0 110.537 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.65 97.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.723 -178.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 103.16 -10.36 54.88 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.875 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.573 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 23.7 t30 -129.27 93.55 3.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.187 0.518 . . . . 0.0 110.85 -178.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 28.6 m -75.1 93.77 2.81 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.712 176.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 173.4 -58.01 0.14 Allowed Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 178.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.44 84.01 5.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.979 0.418 . . . . 0.0 110.208 177.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.63 155.89 29.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.054 177.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.7 m -122.33 131.53 53.95 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.891 0.377 . . . . 0.0 111.422 -177.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.711 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -105.13 134.57 48.01 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.879 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.828 ' HD2' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -89.2 167.19 13.29 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.703 -174.066 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.483 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -58.98 -32.87 70.05 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.413 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -37.85 71.2 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.413 0.625 . . . . 0.0 109.519 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.421 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -65.8 -31.93 73.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.046 175.719 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.483 HD12 ' HA ' ' A' ' 70' ' ' ALA . 3.9 mt -65.37 -35.67 75.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.318 177.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -84.08 -6.49 59.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.064 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.78 -43.86 8.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.292 0.568 . . . . 0.0 109.9 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.2 mp -132.43 -53.87 0.96 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.562 -176.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.18 51.17 2.28 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.034 -179.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.524 ' H ' HD22 ' A' ' 78' ' ' LEU . 1.9 mm? -54.04 100.45 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 122.683 0.393 . . . . 0.0 111.432 -177.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.488 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -76.17 1.72 15.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.55 -176.426 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.451 ' HB1' ' HA ' ' A' ' 41' ' ' THR . . . -72.28 -33.64 67.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.917 0.389 . . . . 0.0 110.946 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.711 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.8 OUTLIER -119.61 4.53 11.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.916 0.389 . . . . 0.0 111.431 -176.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.601 HG23 HD12 ' A' ' 81' ' ' LEU . 97.0 t -109.0 138.8 34.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.887 178.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.896 ' HB2' ' HD3' ' A' ' 92' ' ' LYS . 29.2 t70 -123.43 153.19 40.77 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -118.14 132.35 56.35 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.4 0.619 . . . . 0.0 111.586 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.476 HG23 ' H ' ' A' ' 87' ' ' GLU . 11.7 t -138.66 174.76 10.19 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.812 -1.085 . . . . 0.0 108.111 174.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -68.43 -16.79 64.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.336 0.589 . . . . 0.0 110.716 -178.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.476 ' H ' HG23 ' A' ' 85' ' ' THR . 40.3 mp0 -77.64 -5.48 50.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.553 176.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 114.69 -174.38 15.39 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.188 -0.529 . . . . 0.0 112.652 177.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -65.85 119.75 6.82 Favored 'Trans proline' 0 N--CA 1.463 -0.274 0 C-N-CA 123.037 2.491 . . . . 0.0 111.18 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 3.0 m -133.25 179.91 3.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.921 0.391 . . . . 0.0 111.528 -172.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.57 146.41 50.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.821 177.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.896 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -86.3 -37.52 18.45 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.327 175.424 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -150.57 -87.29 0.07 Allowed 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 120.929 0.395 . . . . 0.0 111.601 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 4.7 mt -92.94 131.27 40.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.563 -169.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.6 p -100.14 132.1 46.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.511 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.605 ' HB3' ' SG ' ' A' ' 35' ' ' CYS . . . -154.33 167.12 31.03 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 120.834 0.35 . . . . 0.0 111.449 -177.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.79 126.35 52.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.019 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.828 ' HB3' ' HD2' ' A' ' 69' ' ' LYS . 11.5 t -135.93 134.35 20.42 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.137 -171.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -82.78 142.75 11.49 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 122.898 2.398 . . . . 0.0 113.042 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -81.23 125.44 30.3 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 169.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 134.72 -113.37 1.13 Allowed Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -175.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -146.85 105.49 3.82 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 117.136 0.468 . . . . 0.0 111.874 179.279 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 171.73 168.64 0.1 Allowed 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 124.813 1.245 . . . . 0.0 108.764 172.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -80.07 171.45 15.07 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.418 -178.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.4 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.04 143.39 43.13 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.272 -178.822 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.467 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 3.7 m -95.26 136.54 25.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.712 -177.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.549 ' HB2' HD11 ' A' ' 59' ' ' LEU . . . -111.07 124.14 51.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.058 0.456 . . . . 0.0 111.135 -177.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -105.89 11.27 8.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.273 -178.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.7 t70 . . . . . 0 C--N 1.321 -0.643 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.003 179.575 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.463 HD11 ' HD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.412 0 CA-C-O 121.307 0.575 . . . . 0.0 109.671 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -155.66 -46.81 0.08 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.09 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.95 -22.01 60.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.142 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.409 ' HB3' ' O ' ' A' ' 89' ' ' PRO . 0.0 OUTLIER -78.68 64.07 3.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.289 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.39 -31.88 70.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.225 0.536 . . . . 0.0 110.409 178.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.41 ' HB2' ' CD ' ' A' ' 87' ' ' GLU . . . -65.76 -31.48 72.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.147 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.585 ' HA ' ' NE2' ' A' ' 21' ' ' GLN . 60.2 t80 -66.38 -40.51 89.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.016 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.67 -27.29 50.81 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.144 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -55.67 -43.25 76.17 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.575 0.702 . . . . 0.0 109.212 173.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.585 ' NE2' ' HA ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -56.4 -49.0 75.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.346 -1.297 . . . . 0.0 111.147 175.721 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.53 ' HB1' HD11 ' A' ' 32' ' ' ILE . . . -82.92 0.61 43.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.137 -173.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -78.1 -15.08 59.2 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.753 0.311 . . . . 0.0 110.662 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.73 -8.75 55.55 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.93 -0.653 . . . . 0.0 111.806 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.31 173.95 6.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.509 0.195 . . . . 0.0 110.553 -179.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.21 97.11 5.44 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.939 0.4 . . . . 0.0 110.949 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.507 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -143.25 155.13 44.42 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.238 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -95.17 170.09 9.64 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.628 0.251 . . . . 0.0 110.635 -176.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.8 p -68.02 126.94 28.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 110.126 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.38 -33.63 5.03 Favored Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -176.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -94.23 25.97 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.218 0.532 . . . . 0.0 110.324 177.563 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.53 HD11 ' HB1' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -112.68 130.17 66.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.113 179.783 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.74 ' HB3' ' SG ' ' A' ' 98' ' ' CYS . . . -149.75 -179.63 7.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.686 0.755 . . . . 0.0 112.524 -172.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.9 t -123.42 132.96 54.11 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.245 175.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.446 ' HB2' HG12 ' A' ' 94' ' ' ILE . 3.9 m -100.36 121.29 41.27 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.853 HD21 ' HB2' ' A' ' 40' ' ' GLU . 14.3 t30 -113.56 148.0 36.94 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.469 -177.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.441 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 45.4 m -54.1 131.13 59.67 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.437 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.451 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 51.9 Cg_exo -53.27 -37.97 81.32 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.489 2.793 . . . . 0.0 114.157 -171.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.64 -18.02 65.15 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.898 0.38 . . . . 0.0 111.915 -175.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.853 ' HB2' HD21 ' A' ' 36' ' ' ASN . 5.0 mm-40 -102.43 -38.86 7.4 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.411 ' O ' HD22 ' A' ' 47' ' ' LEU . 1.8 m -62.49 -30.02 70.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.657 175.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.7 OUTLIER -104.72 13.3 31.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.045 -179.655 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -61.23 -42.3 98.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.336 0.589 . . . . 0.0 110.556 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.933 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 30.3 t0 -96.09 130.4 43.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.6 m -69.51 -23.78 63.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.091 0.472 . . . . 0.0 110.315 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -33.39 62.36 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.199 174.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.933 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -64.48 -32.39 74.0 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.416 178.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.463 ' HA ' HD21 ' A' ' 51' ' ' LEU . 4.2 t -61.65 -22.04 64.93 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.138 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -106.5 -9.87 30.28 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.439 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.699 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 1.1 mp -82.9 -23.33 33.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.921 0.391 . . . . 0.0 110.574 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.463 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.5 OUTLIER -77.34 -29.03 53.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.094 0.474 . . . . 0.0 110.33 176.503 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -98.43 83.37 0.65 Allowed Glycine 0 N--CA 1.441 -1.015 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.004 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -77.41 -6.64 54.12 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.397 0.618 . . . . 0.0 109.944 177.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.3 -126.14 1.27 Allowed Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.023 176.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.431 ' HB2' HG23 ' A' ' 102' ' ' THR . 0.0 OUTLIER -107.66 55.35 0.65 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.291 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.744 HD11 ' HZ1' ' A' ' 69' ' ' LYS . 3.3 mt -79.92 169.73 17.48 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.786 -172.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.462 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 19.4 t-20 -131.59 -179.45 5.39 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.94 175.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.579 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -99.81 -133.24 8.03 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.847 -175.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.801 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 7.9 tp -80.23 152.64 29.0 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.05 89.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.188 0.518 . . . . 0.0 111.152 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.27 -2.27 57.7 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.7 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.801 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 47.4 t30 -124.86 102.28 7.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.018 0.437 . . . . 0.0 110.877 -178.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.42 73.98 6.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.15 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.58 -55.73 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.909 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.64 79.47 4.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.03 0.443 . . . . 0.0 110.823 178.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.579 ' HA ' ' HA2' ' A' ' 58' ' ' GLY . . . -74.72 124.89 27.58 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 173.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.8 m -110.62 128.79 55.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.11 0.481 . . . . 0.0 110.271 -175.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.726 ' HB3' HD22 ' A' ' 81' ' ' LEU . . . -106.21 144.65 32.61 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.804 -174.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.744 ' HZ1' HD11 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -103.51 -174.92 2.66 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.38 -175.424 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.71 -28.57 63.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.565 -178.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -63.95 -42.31 97.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.468 0.651 . . . . 0.0 110.233 177.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.474 ' CB ' ' HB1' ' A' ' 68' ' ' ALA . 0.8 OUTLIER -77.26 -35.89 54.87 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.823 -179.95 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.417 HG12 HG21 ' A' ' 82' ' ' VAL . 3.5 mt -65.54 -37.25 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.358 -179.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -72.91 -41.32 64.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.929 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -76.4 -53.19 8.51 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.328 -173.468 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.484 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -106.19 -44.52 4.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.25 -172.839 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.94 50.24 7.07 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.194 -1.003 . . . . 0.0 112.504 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.59 106.01 0.72 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 122.332 0.253 . . . . 0.0 111.362 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.6 OUTLIER -71.01 -6.53 39.61 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.891 -177.228 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -86.74 -13.75 44.36 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.906 0.384 . . . . 0.0 110.387 177.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.726 HD22 ' HB3' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -108.62 -33.96 6.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.083 -176.331 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.417 HG21 HG12 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -108.46 137.32 40.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.69 179.805 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.431 ' O ' ' HA ' ' A' ' 89' ' ' PRO . 11.3 t70 -98.18 176.01 5.88 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 175.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.91 112.19 7.32 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.946 0.403 . . . . 0.0 111.285 -175.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.473 ' HB ' ' OE1' ' A' ' 86' ' ' GLU . 1.2 p -118.82 -167.64 1.41 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.802 177.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.473 ' OE1' ' HB ' ' A' ' 85' ' ' THR . 0.0 OUTLIER -66.16 -33.27 75.39 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 177.588 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.41 ' CD ' ' HB2' ' A' ' 17' ' ' ALA . 28.0 mt-10 -80.02 4.8 15.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.437 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 103.8 -155.48 17.75 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.764 173.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.431 ' HA ' ' O ' ' A' ' 83' ' ' ASP . 73.2 Cg_endo -73.4 126.13 10.73 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.876 2.384 . . . . 0.0 111.27 177.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -133.12 175.07 12.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.29 -173.137 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.07 116.96 9.29 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.997 178.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.5 tttp -76.19 -25.11 54.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.279 0.562 . . . . 0.0 110.433 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -133.02 -106.21 0.25 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.861 -176.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.446 HG12 ' HB2' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -113.69 149.11 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.831 0.348 . . . . 0.0 111.042 -174.18 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 1.5 t -80.87 144.75 10.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.556 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -154.2 170.2 21.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.03 0.443 . . . . 0.0 111.763 -177.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.507 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.6 m -124.33 108.42 12.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.0 177.244 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.74 ' SG ' ' HB3' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -127.85 141.71 42.0 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.243 -174.017 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -87.81 154.57 7.38 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.165 2.576 . . . . 0.0 113.099 -179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.45 ' CD ' ' HZ2' ' A' ' 69' ' ' LYS . 3.6 tp10 -98.26 117.62 33.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.401 173.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 145.06 -67.78 0.42 Allowed Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.008 177.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.431 HG23 ' HB2' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -157.4 177.33 11.55 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.561 HG22 ' H ' ' A' ' 104' ' ' ASN . 1.4 m 69.79 167.59 0.29 Allowed 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.603 0.716 . . . . 0.0 111.919 177.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.561 ' H ' HG22 ' A' ' 103' ' ' THR . 4.5 p30 -89.88 -179.29 5.69 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.542 -171.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 98' ' ' CYS . 7.2 t -112.79 148.69 34.29 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.745 -175.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.0 m -104.26 138.34 29.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.953 0.406 . . . . 0.0 110.204 178.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.86 117.79 27.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.817 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -121.49 26.41 3.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.953 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.1 t70 . . . . . 0 C--O 1.235 0.33 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.006 176.892 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.374 0 CA-C-O 121.434 0.635 . . . . 0.0 109.97 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.04 -8.7 59.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.608 -177.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.48 6.82 8.94 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.929 0.395 . . . . 0.0 111.559 -177.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 m -61.97 -50.6 71.46 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.422 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 60.72 -73.44 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.743 0.652 . . . . 0.0 112.071 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.5 -28.66 69.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.566 -178.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -62.9 -38.61 91.63 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.183 0.516 . . . . 0.0 110.257 176.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -71.58 -22.06 61.78 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.837 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.468 ' HA ' ' HG2' ' A' ' 23' ' ' GLU . 16.9 mtpp -75.65 -22.25 56.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.723 0.773 . . . . 0.0 109.052 178.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -82.3 -41.95 19.45 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.522 173.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.44 ' HB1' HD11 ' A' ' 32' ' ' ILE . . . -74.69 -17.34 60.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.988 -1.005 . . . . 0.0 112.266 -175.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.468 ' HG2' ' HA ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -77.17 -9.2 58.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.675 0.274 . . . . 0.0 111.039 179.228 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.72 -20.04 58.8 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.669 -0.776 . . . . 0.0 112.216 177.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -125.48 123.29 38.88 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.15 97.67 1.23 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.268 0.556 . . . . 0.0 111.945 -176.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.3 m -140.85 152.52 45.18 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 173.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -84.2 153.93 23.36 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -173.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.05 -40.99 84.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -176.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.0 -8.86 86.95 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.528 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.1 10.06 12.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.033 0.444 . . . . 0.0 110.803 -178.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.44 HD11 ' HB1' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -90.24 137.94 20.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.626 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . . . -149.64 -178.69 6.58 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -170.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.533 ' HB3' ' HB2' ' A' ' 81' ' ' LEU . 4.4 t -144.43 142.15 30.11 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.278 173.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.844 ' HB2' ' HB ' ' A' ' 94' ' ' ILE . 78.6 m -113.86 158.32 21.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.839 0.352 . . . . 0.0 110.401 179.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -145.26 150.72 37.17 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -42.96 139.45 2.15 Favored Pre-proline 0 C--O 1.235 0.33 0 O-C-N 123.733 0.646 . . . . 0.0 112.436 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.517 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 70.4 Cg_exo -51.22 -54.6 5.13 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.596 2.864 . . . . 0.0 113.881 -172.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.9 -7.7 23.9 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -172.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -100.56 -51.36 3.63 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.771 0.32 . . . . 0.0 110.718 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.487 HG23 HD21 ' A' ' 51' ' ' LEU . 1.3 m -68.35 -33.3 74.03 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.388 0.613 . . . . 0.0 110.606 178.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.517 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.3 m-80 -101.34 14.38 32.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.654 -178.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -61.31 -41.91 97.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.379 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.835 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 35.5 t70 -94.96 140.27 30.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.558 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -42.05 97.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.183 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.35 -33.55 73.26 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.862 0.363 . . . . 0.0 110.38 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.835 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -59.9 -36.77 77.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.772 177.415 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.34 -23.28 66.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.933 0.396 . . . . 0.0 110.981 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -98.5 -7.02 56.23 Favored Glycine 0 C--N 1.329 0.189 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.496 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.446 HD21 ' HB3' ' A' ' 78' ' ' LEU . 2.6 tt -82.3 -31.25 30.07 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.009 0.433 . . . . 0.0 110.43 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.487 HD21 HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -75.83 -16.23 60.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.881 179.003 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.59 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -113.81 77.99 0.25 Allowed Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 120.957 -0.64 . . . . 0.0 112.225 -176.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.95 54.06 1.51 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.243 0.544 . . . . 0.0 110.412 177.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.01 -117.74 1.04 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 -177.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.9 mt -117.6 49.14 1.25 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.252 0.549 . . . . 0.0 109.778 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.59 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 1.0 OUTLIER -82.72 175.84 9.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.275 -171.362 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.551 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 6.2 t-20 -135.86 -178.79 5.29 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.299 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -111.79 -132.12 5.87 Favored Glycine 0 C--N 1.315 -0.606 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 -177.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.417 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.1 OUTLIER -66.42 149.8 49.86 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 175.684 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.4 m -65.43 89.72 0.1 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.139 0.495 . . . . 0.0 110.957 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.1 -37.24 3.85 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.604 178.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -89.69 98.62 11.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.912 0.387 . . . . 0.0 111.332 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.69 72.16 2.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.152 179.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -169.76 -51.37 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 111.188 -0.765 . . . . 0.0 111.188 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.02 77.73 6.7 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.043 0.449 . . . . 0.0 110.533 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.51 142.45 40.88 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.772 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 4.6 m -123.11 148.41 45.7 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.374 -0.531 . . . . 0.0 111.081 -174.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 1.021 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -107.59 139.26 42.4 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.27 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.782 ' HE3' HD22 ' A' ' 72' ' ' LEU . 0.0 OUTLIER -94.3 167.38 11.57 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.402 179.763 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.73 -30.69 69.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.058 0.456 . . . . 0.0 110.083 176.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -27.02 68.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.885 176.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.782 HD22 ' HE3' ' A' ' 69' ' ' LYS . 1.1 tp -91.14 -24.9 19.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.893 0.378 . . . . 0.0 110.733 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 76.2 mt -72.75 -29.17 29.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 172.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.11 -12.82 59.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.006 172.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.604 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 1.1 tp-100 -93.97 -45.31 7.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.342 -178.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.0 mp -120.28 -41.94 2.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.688 -174.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.61 50.03 3.25 Favored Glycine 0 CA--C 1.515 0.087 0 C-N-CA 120.105 -1.045 . . . . 0.0 112.13 -178.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.472 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -81.56 164.19 22.1 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.699 0.285 . . . . 0.0 111.64 -175.519 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.56 -0.83 9.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.977 -177.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.56 -35.46 68.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -173.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 1.021 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -116.67 27.07 9.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.761 0.315 . . . . 0.0 111.118 -176.734 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.534 HG11 ' HB3' ' A' ' 89' ' ' PRO . 2.0 t -119.21 137.12 54.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.466 178.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.912 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 2.6 t70 -124.13 177.4 5.83 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.987 0.422 . . . . 0.0 111.602 -176.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -56.82 133.4 54.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.853 -175.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.526 HG21 ' HA ' ' A' ' 89' ' ' PRO . 5.7 t -159.32 150.28 19.78 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.106 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -108.53 -19.57 13.4 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.951 0.405 . . . . 0.0 110.474 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -90.36 -46.44 8.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.463 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.441 ' O ' HG13 ' A' ' 90' ' ' VAL . . . 174.14 149.3 6.97 Favored Glycine 0 N--CA 1.444 -0.798 0 N-CA-C 111.219 -0.752 . . . . 0.0 111.219 -177.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.534 ' HB3' HG11 ' A' ' 82' ' ' VAL . 88.8 Cg_exo -45.61 126.85 9.17 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 123.812 3.008 . . . . 0.0 113.393 -173.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.489 HG22 ' HB ' ' A' ' 85' ' ' THR . 8.7 m -127.43 -179.81 3.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.409 -176.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.76 135.06 52.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.069 -177.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.912 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.5 tttp -85.77 -28.28 24.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.489 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.412 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -148.21 -92.2 0.08 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -169.696 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.844 ' HB ' ' HB2' ' A' ' 35' ' ' CYS . 8.7 mt -101.16 117.15 46.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.091 -168.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.5 t -73.95 125.99 33.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.231 -0.44 . . . . 0.0 109.971 176.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -154.54 176.6 12.19 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.001 -176.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 53.6 m -128.13 127.57 43.27 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.218 177.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.773 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 19.2 m -120.72 137.37 26.3 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.394 -174.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -86.33 155.16 9.41 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 122.428 2.086 . . . . 0.0 111.475 170.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.69 156.04 17.55 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 173.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 97.49 -71.55 0.7 Allowed Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.368 -178.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -150.55 172.03 16.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.511 0.196 . . . . 0.0 111.528 -176.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.482 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.2 OUTLIER 74.48 168.04 0.29 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.644 0.778 . . . . 0.0 113.052 172.076 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.551 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.4 OUTLIER -95.35 178.37 5.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.79 -1.095 . . . . 0.0 112.145 -170.239 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 4.4 m -112.89 142.65 45.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.875 -176.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -90.76 148.99 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 174.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -107.04 140.98 38.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.595 0.236 . . . . 0.0 111.098 -176.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -129.81 20.45 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.826 0.346 . . . . 0.0 111.266 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.377 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 176.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.532 ' HB2' ' OG ' ' A' ' 15' ' ' SER . 5.0 mp . . . . . 0 N--CA 1.465 0.285 0 CA-C-O 120.589 0.233 . . . . 0.0 110.564 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.53 38.73 30.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.249 -179.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 58.76 50.14 9.14 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.68 -174.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.558 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 0.5 OUTLIER -51.99 -52.54 49.84 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.597 -176.408 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.3 -56.64 0.44 Allowed 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.575 0.75 . . . . 0.0 111.599 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.9 -35.71 81.39 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.017 0.437 . . . . 0.0 110.919 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -68.87 -25.12 64.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.479 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.51 -24.24 60.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.458 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -67.98 -29.8 68.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 176.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.29 -27.66 59.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.406 -1.27 . . . . 0.0 110.519 177.274 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.12 -18.83 62.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.682 -176.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.06 -8.11 13.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.029 0.442 . . . . 0.0 110.563 175.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -83.44 -24.94 49.22 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.496 -0.859 . . . . 0.0 111.116 175.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.38 135.01 48.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -74.73 96.91 3.12 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.017 0.437 . . . . 0.0 111.592 -176.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 60.9 m -145.47 136.05 24.27 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 175.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -69.14 144.41 53.86 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.471 -0.196 . . . . 0.0 110.471 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.4 HG23 ' H ' ' A' ' 29' ' ' VAL . 1.6 t -62.95 -36.67 76.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.691 0.282 . . . . 0.0 111.255 -178.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.54 -7.98 88.0 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.999 -0.619 . . . . 0.0 112.289 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.21 38.72 3.13 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.948 0.404 . . . . 0.0 110.133 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.5 tt -99.06 134.43 38.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.523 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -147.97 171.54 15.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.127 0.489 . . . . 0.0 111.585 -172.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.466 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 2.0 t -120.28 145.65 46.87 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.076 172.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -128.68 157.61 40.87 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -176.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.47 ' HB2' ' CD1' ' A' ' 81' ' ' LEU . 10.6 t-20 -151.26 160.42 43.82 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 -177.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.52 146.79 23.01 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.011 176.103 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.604 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 10.7 Cg_endo -54.08 -38.13 87.09 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.154 2.569 . . . . 0.0 112.976 -176.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.5 -13.97 62.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.966 0.413 . . . . 0.0 111.717 -175.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -103.39 -50.11 3.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.638 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 22.7 m -59.76 -36.83 77.46 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.795 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.604 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.9 m-80 -104.8 16.93 25.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.029 -176.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -56.03 -27.68 54.2 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.725 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.993 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 12.2 t70 -116.17 133.28 56.19 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 172.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 17.2 m -66.88 -21.21 66.01 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -176.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.1 tp -91.09 -25.3 19.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.245 0.545 . . . . 0.0 110.12 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.993 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 3.1 tp -61.57 -37.63 84.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.47 -177.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.623 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -64.64 -20.14 66.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.91 -177.084 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -95.96 -9.73 56.95 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.045 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.587 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 2.0 mp -85.82 -26.07 25.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.825 0.345 . . . . 0.0 111.154 -177.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.623 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.3 OUTLIER -80.03 -11.11 59.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.939 0.4 . . . . 0.0 111.744 -175.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.637 ' HA3' ' CB ' ' A' ' 56' ' ' LEU . . . -128.05 91.28 0.34 Allowed Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.808 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.412 ' H ' HD21 ' A' ' 72' ' ' LEU . . . -77.91 74.68 4.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.258 0.551 . . . . 0.0 110.648 -178.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 159.49 -69.53 0.25 Allowed Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.136 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.2 tp -136.54 -40.72 0.63 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.637 ' CB ' ' HA3' ' A' ' 52' ' ' GLY . 0.1 OUTLIER 69.13 134.34 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 122.435 1.112 . . . . 0.0 112.672 178.603 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.565 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 8.8 t-20 -141.44 -178.8 5.79 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 114.202 -1.363 . . . . 0.0 107.9 171.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.692 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -114.97 -145.44 8.71 Favored Glycine 0 C--N 1.312 -0.768 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.62 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.468 ' HB3' ' HB2' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -65.2 156.28 32.33 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.469 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.7 m -52.28 101.94 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.099 0.476 . . . . 0.0 111.726 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 74.67 18.63 80.04 Favored Glycine 0 C--N 1.338 0.663 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.529 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.468 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 4.1 t30 -123.29 94.52 4.28 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.866 0.365 . . . . 0.0 110.795 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.06 99.67 7.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.065 0.459 . . . . 0.0 111.051 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 155.7 -55.37 0.41 Allowed Glycine 0 CA--C 1.508 -0.348 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 177.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.78 84.15 6.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.954 0.407 . . . . 0.0 109.999 175.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.692 ' HA ' ' HA2' ' A' ' 58' ' ' GLY . . . -90.54 150.81 21.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.936 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 m -124.26 136.34 54.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.972 0.415 . . . . 0.0 111.195 -174.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -105.63 139.23 40.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.95 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -95.54 168.24 10.81 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.732 -173.885 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.49 -33.32 73.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.047 0.451 . . . . 0.0 111.026 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -31.01 71.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.331 0.586 . . . . 0.0 110.173 177.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.458 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.0 OUTLIER -79.73 -21.65 44.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.686 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.94 -41.5 89.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.368 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -90.22 -0.44 57.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.461 . . . . 0.0 110.746 179.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.79 -52.95 4.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.535 178.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.587 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 1.1 mm? -118.67 -46.22 2.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.131 -177.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 101.97 52.54 1.01 Allowed Glycine 0 CA--C 1.519 0.315 0 C-N-CA 119.724 -1.227 . . . . 0.0 113.388 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.491 ' HG ' ' HB3' ' A' ' 51' ' ' LEU . 3.9 mm? -64.48 92.34 0.09 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.989 0.424 . . . . 0.0 111.736 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.8 -11.65 60.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.686 -178.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.24 -15.46 46.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.174 0.511 . . . . 0.0 110.621 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.47 ' CD1' ' HB2' ' A' ' 36' ' ' ASN . 0.0 OUTLIER -108.37 -16.35 14.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.622 -176.258 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.33 137.85 46.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.187 0.518 . . . . 0.0 110.976 -178.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.636 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 3.2 t70 -113.85 176.91 4.83 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 176.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -135.19 124.7 24.99 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -171.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.15 -169.34 1.63 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.988 -1.006 . . . . 0.0 108.962 171.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.02 -29.15 61.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.849 0.357 . . . . 0.0 110.778 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.558 ' HB3' ' O ' ' A' ' 15' ' ' SER . 35.3 mp0 -76.6 -14.52 59.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.621 -178.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 135.51 -165.52 24.73 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 119.964 -1.113 . . . . 0.0 112.728 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -74.49 125.6 9.71 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.88 2.386 . . . . 0.0 111.802 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -124.15 -177.96 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.079 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.28 129.93 40.65 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 178.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.636 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 11.8 tttp -79.74 -27.69 40.54 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.639 -176.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -155.02 -90.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -172.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.415 HD12 ' HA ' ' A' ' 36' ' ' ASN . 5.2 mt -95.63 138.66 20.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.002 -171.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.6 t -101.67 123.09 54.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.586 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.15 157.92 43.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.909 -177.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.36 124.26 49.25 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 177.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.442 ' CA ' ' HB3' ' A' ' 105' ' ' CYS . 8.3 t -135.45 133.03 20.12 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.188 -171.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.409 ' O ' ' HD2' ' A' ' 69' ' ' LYS . 36.9 Cg_endo -65.84 171.77 9.35 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.755 2.304 . . . . 0.0 111.683 174.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.63 -82.49 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -171.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -128.02 0.76 6.67 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.064 -1.065 . . . . 0.0 113.413 -174.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.03 142.32 51.57 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.682 0.241 . . . . 0.0 111.511 -175.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 6.3 m 73.59 157.32 0.19 Allowed 'General case' 0 CA--C 1.532 0.286 0 O-C-N 123.882 0.739 . . . . 0.0 112.304 175.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.565 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.7 OUTLIER -73.11 168.9 18.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.762 -175.374 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.442 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -113.22 141.82 46.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.027 -179.403 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -83.3 145.99 7.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.065 174.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.94 115.69 23.02 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.458 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -85.89 -8.63 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-O 121.837 0.827 . . . . 0.0 110.071 177.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.308 -1.222 0 CA-C-N 114.315 -1.311 . . . . 0.0 108.512 176.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.469 0.506 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.3 -34.86 78.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.709 0.29 . . . . 0.0 111.39 179.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.71 -20.15 47.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.81 0.338 . . . . 0.0 111.641 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.684 ' HA ' ' O ' ' A' ' 87' ' ' GLU . 0.3 OUTLIER -76.19 68.15 2.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.211 0.529 . . . . 0.0 111.317 179.295 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.75 -19.9 66.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.851 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -82.04 -26.89 33.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.503 177.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.553 ' O ' ' HB2' ' A' ' 21' ' ' GLN . 41.2 t80 -82.73 -41.55 19.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.758 -178.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.76 -18.91 61.66 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.7 mttp -67.33 -18.01 64.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.014 0.435 . . . . 0.0 110.533 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.553 ' HB2' ' O ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -63.69 -28.1 69.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.562 177.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.05 -18.56 62.56 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.406 -178.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -98.35 -41.53 7.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.487 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -66.41 -30.33 76.39 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.679 177.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.601 HG21 HG21 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -133.62 123.02 24.32 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 176.241 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.79 97.64 1.82 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.02 0.438 . . . . 0.0 111.464 -176.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.465 ' HB2' HD12 ' A' ' 32' ' ' ILE . 79.8 m -139.51 -178.43 5.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.653 179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.701 ' H ' ' HB2' ' A' ' 31' ' ' SER . 30.0 t-20 -122.03 176.61 5.71 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 -176.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.43 HG23 ' H ' ' A' ' 30' ' ' GLY . 2.5 m -52.76 -53.49 20.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -178.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.43 ' H ' HG23 ' A' ' 29' ' ' VAL . . . -89.41 20.62 33.21 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.961 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.701 ' HB2' ' H ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -123.61 -12.2 7.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.849 0.357 . . . . 0.0 110.839 177.044 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.465 HD12 ' HB2' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -82.22 127.26 39.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 175.684 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.72 153.99 38.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.152 0.501 . . . . 0.0 111.462 -174.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.433 ' O ' HD13 ' A' ' 81' ' ' LEU . 11.5 t -122.7 143.06 50.04 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.628 176.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -127.54 163.83 23.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.605 0.716 . . . . 0.0 110.985 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.462 ' HB2' ' HA ' ' A' ' 81' ' ' LEU . 20.2 t-20 -136.14 160.82 37.51 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.19 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -45.8 137.07 5.99 Favored Pre-proline 0 C--N 1.329 -0.292 0 O-C-N 123.588 0.555 . . . . 0.0 110.457 177.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.496 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 79.7 Cg_exo -48.54 -36.84 32.58 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 123.254 2.636 . . . . 0.0 113.351 -175.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.02 -7.82 50.99 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -177.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.4 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 0.9 OUTLIER -109.18 -41.78 4.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.127 0.489 . . . . 0.0 109.86 178.551 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.437 HG21 ' HB3' ' A' ' 66' ' ' ALA . 29.0 m -65.45 -37.05 85.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.671 175.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.496 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.3 m-80 -100.27 15.31 28.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.707 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.4 ' HB2' ' HA ' ' A' ' 40' ' ' GLU . 10.1 t-20 -65.11 -32.75 74.61 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.474 -176.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.931 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.6 t70 -104.8 146.6 28.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.636 178.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.86 -36.94 75.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.002 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.3 tp -86.47 -20.89 27.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.134 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.931 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -53.73 -47.54 70.49 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.109 0.481 . . . . 0.0 111.203 179.047 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.59 -18.24 65.26 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.22 -178.304 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -93.98 -29.13 10.04 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.737 176.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.457 HD22 ' HG ' ' A' ' 76' ' ' LEU . 27.9 mt -74.11 -24.53 59.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 176.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.444 ' HA ' HD13 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -55.67 -51.8 66.02 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.691 173.219 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -87.02 74.23 2.35 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.842 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -100.9 32.92 2.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.593 0.711 . . . . 0.0 109.334 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 160.73 -111.88 0.5 Allowed Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.51 -174.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.567 HD12 ' HA2' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -117.15 72.33 0.83 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.364 0.602 . . . . 0.0 110.392 176.896 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.66 ' HG ' ' HZ2' ' A' ' 69' ' ' LYS . 1.5 mp -123.44 134.1 53.98 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.253 178.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -128.42 -177.34 4.13 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.297 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.72 -162.83 35.06 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.617 -0.802 . . . . 0.0 113.073 -173.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.402 HD23 ' HB2' ' A' ' 65' ' ' SER . 0.4 OUTLIER -65.35 158.2 27.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.508 0.194 . . . . 0.0 110.494 -179.679 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.968 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -61.07 88.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.464 0.65 . . . . 0.0 112.283 -177.638 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.03 4.1 78.76 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.454 -0.794 . . . . 0.0 113.11 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.4 t30 -117.66 134.6 54.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 117.123 0.461 . . . . 0.0 111.422 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.0 125.99 47.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.407 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.11 -49.37 0.93 Allowed Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.856 -0.687 . . . . 0.0 111.752 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.402 ' HB2' HD23 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -82.56 115.5 21.57 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 175.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.437 ' HB3' HG21 ' A' ' 41' ' ' THR . . . -127.77 147.34 50.41 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.265 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.9 m -121.08 135.63 55.15 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.909 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.806 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -105.82 152.45 23.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 176.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.66 ' HZ2' ' HG ' ' A' ' 56' ' ' LEU . 0.0 OUTLIER -111.62 -177.2 3.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.385 -176.956 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.3 -24.5 67.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.073 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -66.77 -31.02 71.38 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.417 0.627 . . . . 0.0 110.027 178.773 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.481 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -90.43 -33.72 15.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.709 179.632 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.1 mt -65.87 -39.45 84.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.597 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -84.48 -2.97 58.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.899 0.381 . . . . 0.0 110.841 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -94.75 -53.31 3.91 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.052 0.453 . . . . 0.0 110.823 178.38 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.468 ' HA ' HD13 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -126.28 -28.57 3.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.804 -175.339 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.04 50.69 4.49 Favored Glycine 0 C--O 1.228 -0.274 0 C-N-CA 120.343 -0.932 . . . . 0.0 111.929 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.6 mt -59.19 96.15 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.766 0.426 . . . . 0.0 111.944 -176.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.435 ' HG ' ' H ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -79.17 6.26 10.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.414 -177.15 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.97 -26.47 64.11 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.255 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.806 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -129.9 2.1 4.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.714 -176.292 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 39.0 t -111.69 138.25 41.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.12 0.486 . . . . 0.0 110.97 -175.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 3.3 t70 -123.87 177.31 5.81 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.427 176.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -136.2 137.74 41.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.048 0.451 . . . . 0.0 112.202 -172.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -135.56 -169.3 2.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.669 174.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -42.93 99.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.145 0.497 . . . . 0.0 109.968 177.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.684 ' O ' ' HA ' ' A' ' 15' ' ' SER . 3.1 mp0 -81.57 43.29 0.74 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.47 -179.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 80.89 -170.37 52.97 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.974 -0.557 . . . . 0.0 113.52 173.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.452 ' O ' ' HB3' ' A' ' 15' ' ' SER . 11.0 Cg_exo -70.84 134.5 25.84 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 123.072 2.514 . . . . 0.0 111.369 174.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.46 ' HB ' ' H ' ' A' ' 91' ' ' CYS . 0.6 OUTLIER -132.81 -153.6 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.66 -174.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.46 ' H ' ' HB ' ' A' ' 90' ' ' VAL . 0.5 OUTLIER -94.45 152.87 18.26 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.428 -178.036 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.433 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 1.1 tttt -92.92 -34.82 13.63 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.29 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -159.12 -62.4 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.416 HG23 ' HB3' ' A' ' 109' ' ' ASP . 33.3 mt -112.27 132.6 60.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.905 0.383 . . . . 0.0 111.809 -171.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.459 HG22 HG23 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -105.16 139.02 27.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.489 175.824 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.417 ' CB ' ' HA ' ' A' ' 107' ' ' ALA . . . -149.94 167.57 26.29 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 121.22 0.534 . . . . 0.0 111.859 -176.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 4.2 t -112.46 114.71 27.54 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.103 176.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.632 ' O ' ' HA ' ' A' ' 31' ' ' SER . 46.8 t -135.05 106.72 10.39 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.799 -174.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.665 ' HD2' HG21 ' A' ' 102' ' ' THR . 25.9 Cg_exo -67.54 144.83 68.34 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.958 2.439 . . . . 0.0 112.251 173.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.32 72.03 3.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.494 0.664 . . . . 0.0 109.802 171.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.567 ' HA2' HD12 ' A' ' 55' ' ' LEU . . . 145.11 63.46 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.313 -177.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.665 HG21 ' HD2' ' A' ' 99' ' ' PRO . 12.0 t -148.29 156.69 42.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.943 0.401 . . . . 0.0 111.061 -176.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -38.54 87.18 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.521 177.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.968 ' HB2' ' HA ' ' A' ' 60' ' ' SER . 0.2 OUTLIER -155.14 159.49 40.22 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.735 176.589 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.461 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 1.8 m -111.63 140.39 46.28 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 176.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -96.74 136.81 26.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.235 0.541 . . . . 0.0 111.477 -175.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.417 ' HA ' ' CB ' ' A' ' 96' ' ' ALA . . . -90.83 130.04 36.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.924 176.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.601 HG21 HG21 ' A' ' 25' ' ' THR . 0.0 OUTLIER -95.22 -6.26 10.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.423 0.63 . . . . 0.0 111.013 -179.004 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . 0.416 ' HB3' HG23 ' A' ' 94' ' ' ILE . 2.7 t70 . . . . . 0 C--N 1.316 -0.861 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.389 175.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.445 ' HB2' ' HB3' ' A' ' 15' ' ' SER . 5.2 mp . . . . . 0 CA--C 1.529 0.163 0 CA-C-O 120.014 -0.041 . . . . 0.0 110.983 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 36.82 74.05 0.08 Allowed 'General case' 0 N--CA 1.472 0.636 0 O-C-N 124.144 0.903 . . . . 0.0 112.986 175.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.27 62.71 1.14 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.602 0.715 . . . . 0.0 111.083 -177.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.445 ' HB3' ' HB2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -85.25 49.69 1.8 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.135 -177.316 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.413 ' HB3' ' OE1' ' A' ' 87' ' ' GLU . . . -67.67 -51.44 49.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.49 -33.08 70.89 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.479 176.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.606 ' HB2' HG12 ' A' ' 90' ' ' VAL . 23.7 t80 -70.25 -47.1 62.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.056 0.455 . . . . 0.0 110.335 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.8 -23.98 64.35 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.915 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -67.9 -25.08 65.31 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.847 0.832 . . . . 0.0 109.254 177.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.11 -38.16 11.75 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.409 -1.268 . . . . 0.0 110.601 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.73 -17.81 64.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.97 -176.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.62 -8.02 57.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.939 0.399 . . . . 0.0 110.677 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.31 1.72 37.45 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.802 -0.714 . . . . 0.0 111.44 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.433 HG21 ' HB ' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -114.65 124.55 52.12 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.297 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.43 94.59 2.1 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.08 0.467 . . . . 0.0 111.06 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 27.7 m -151.85 -177.53 6.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.036 179.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -112.7 151.32 30.36 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 176.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.9 t -58.29 -40.89 79.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.917 0.389 . . . . 0.0 111.066 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.51 8.33 54.58 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.486 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -143.58 32.46 1.3 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.944 0.402 . . . . 0.0 110.312 178.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.9 134.86 31.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.503 ' CB ' ' HB3' ' A' ' 98' ' ' CYS . . . -149.2 170.88 17.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.254 0.549 . . . . 0.0 111.974 -175.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.2 t -118.26 141.87 48.07 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.829 173.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -126.17 156.29 40.39 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.398 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.456 ' HA ' HD12 ' A' ' 94' ' ' ILE . 56.0 t30 -156.2 160.37 39.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.172 178.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.597 ' HB2' ' OE1' ' A' ' 40' ' ' GLU . 1.5 m -59.61 148.45 74.64 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.069 -177.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.63 ' HA ' HG22 ' A' ' 41' ' ' THR . 32.4 Cg_endo -65.79 -26.72 52.37 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.031 2.488 . . . . 0.0 113.424 -175.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.23 -11.92 58.71 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.142 0.496 . . . . 0.0 111.312 -176.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.597 ' OE1' ' HB2' ' A' ' 37' ' ' SER . 1.9 mp0 -108.17 -51.03 2.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.229 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.63 HG22 ' HA ' ' A' ' 38' ' ' PRO . 1.2 t -69.63 -20.56 63.6 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.296 -176.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.582 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.1 m-80 -105.47 3.46 29.55 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 -178.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -71.76 -46.92 56.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.741 0.305 . . . . 0.0 111.386 -176.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 1.046 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 61.1 t0 -75.68 133.6 40.77 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 178.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -23.61 66.94 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.633 178.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.608 ' HG ' HD13 ' A' ' 50' ' ' LEU . 11.3 tp -87.14 -32.6 19.79 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.288 177.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 1.046 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -64.52 -34.22 77.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.145 -177.185 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -18.12 64.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.074 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -102.73 -30.44 5.52 Favored Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 111.374 -0.69 . . . . 0.0 111.374 173.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.67 ' HG ' ' HB3' ' A' ' 76' ' ' LEU . 1.9 mp -60.28 -36.45 77.85 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 122.667 0.387 . . . . 0.0 110.992 178.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.8 pp -73.4 -11.25 60.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.005 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.61 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -111.99 66.31 0.24 Allowed Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.227 -178.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.442 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -78.87 66.7 4.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.907 0.384 . . . . 0.0 111.4 -178.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 90.43 82.92 1.38 Allowed Glycine 0 C--O 1.226 -0.356 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.04 176.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.5 tp 63.27 20.57 12.35 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.857 0.463 . . . . 0.0 112.029 176.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.789 HD22 ' HA2' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -53.87 145.84 15.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.816 178.089 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -113.24 -178.23 3.33 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.452 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -109.03 -158.28 18.61 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.073 -176.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.74 HD23 ' HB3' ' A' ' 62' ' ' ASN . 1.2 tp -77.5 138.42 39.2 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 120.737 0.303 . . . . 0.0 110.216 178.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.6 m -53.34 108.05 0.3 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.444 -175.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.11 -12.87 64.9 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.549 173.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.74 ' HB3' HD23 ' A' ' 59' ' ' LEU . 18.8 t30 -127.92 114.57 17.34 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.321 0.581 . . . . 0.0 110.954 -178.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.11 160.08 30.11 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.919 -178.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.419 ' C ' ' HB3' ' A' ' 38' ' ' PRO . . . 94.92 -42.45 2.39 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.617 178.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.446 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 0.7 OUTLIER -81.98 117.62 22.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.874 0.369 . . . . 0.0 110.48 -178.761 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.16 143.86 34.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.08 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.68 128.69 55.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.028 0.442 . . . . 0.0 110.858 -178.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.529 ' HB2' HD12 ' A' ' 81' ' ' LEU . . . -112.78 129.83 56.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.95 -177.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.774 ' HZ1' HD11 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -95.94 173.27 7.53 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.539 -178.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.444 ' HA ' HD13 ' A' ' 73' ' ' ILE . . . -58.24 -29.94 66.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.911 0.386 . . . . 0.0 111.207 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -28.3 68.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.096 178.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.657 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 2.0 mp -86.37 -17.71 33.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.061 0.458 . . . . 0.0 110.586 -179.031 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.453 HG13 HG21 ' A' ' 82' ' ' VAL . 0.5 OUTLIER -63.59 -41.53 92.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.969 177.901 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -89.52 -12.83 38.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.271 0.558 . . . . 0.0 110.564 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.657 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.5 OUTLIER -77.04 -53.53 7.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.222 -178.344 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.67 ' HB3' ' HG ' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -125.5 -29.99 3.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.312 -175.824 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.31 48.69 18.1 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 120.302 -0.951 . . . . 0.0 111.999 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.412 ' H ' HD12 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -74.95 97.29 3.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.833 0.349 . . . . 0.0 111.129 -177.716 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.34 8.46 2.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.366 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.28 -27.28 47.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.019 0.438 . . . . 0.0 109.935 174.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.529 HD12 ' HB2' ' A' ' 68' ' ' ALA . 7.9 mt -117.83 -5.62 11.06 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.597 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.453 HG21 HG13 ' A' ' 73' ' ' ILE . 11.6 t -117.46 138.0 49.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.481 178.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -132.49 178.06 7.12 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.079 178.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -136.03 98.89 3.99 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.842 0.353 . . . . 0.0 111.205 -174.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.5 t -82.3 -173.6 4.65 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.866 175.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -78.72 55.36 1.67 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.076 0.465 . . . . 0.0 110.808 -178.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.413 ' OE1' ' HB3' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -161.11 -59.88 0.05 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.854 -178.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -171.82 -174.48 39.39 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.811 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.09 121.3 7.92 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.755 2.303 . . . . 0.0 110.76 174.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.606 HG12 ' HB2' ' A' ' 18' ' ' PHE . 2.7 m -136.28 -174.31 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.211 0.529 . . . . 0.0 111.619 -170.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.49 130.62 43.62 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.902 177.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.1 tttt -71.91 -43.91 64.56 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.012 0.434 . . . . 0.0 110.311 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -149.56 -100.92 0.07 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.257 -173.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.456 HD12 ' HA ' ' A' ' 36' ' ' ASN . 6.7 mt -73.61 126.88 35.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.765 -169.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.433 ' HB ' HG21 ' A' ' 25' ' ' THR . 0.1 OUTLIER -89.57 133.14 32.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.242 177.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.463 ' HB1' ' O ' ' A' ' 106' ' ' VAL . . . -153.5 167.53 29.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.139 0.495 . . . . 0.0 111.83 -175.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -109.26 132.75 53.82 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 174.741 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.517 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 44.0 t -152.45 135.0 8.99 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-O 120.81 0.338 . . . . 0.0 111.636 -171.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.413 ' O ' ' HD2' ' A' ' 69' ' ' LYS . 75.2 Cg_endo -77.29 -177.84 4.14 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 123.411 2.741 . . . . 0.0 111.019 172.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -76.28 -121.59 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -176.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.789 ' HA2' HD22 ' A' ' 56' ' ' LEU . . . -92.52 51.7 2.69 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 121.074 -0.584 . . . . 0.0 112.983 -176.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.35 137.23 1.08 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 176.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.2 m 72.85 147.69 0.09 Allowed 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.24 0.962 . . . . 0.0 111.653 178.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -73.09 164.11 27.17 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.857 -177.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.517 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.8 OUTLIER -111.12 143.17 42.27 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.696 -179.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.463 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 0.9 OUTLIER -100.69 138.7 24.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.057 0.456 . . . . 0.0 110.435 -177.693 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.98 122.93 41.7 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.935 178.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -98.23 14.2 4.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.265 0.555 . . . . 0.0 111.051 -177.288 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 35.8 t0 . . . . . 0 C--N 1.321 -0.641 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.893 174.361 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.401 HD22 ' HA ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.469 0.475 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.84 -33.74 76.35 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.091 0.472 . . . . 0.0 111.016 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -4.7 57.45 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.659 -179.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.507 ' HA ' ' HA3' ' A' ' 88' ' ' GLY . 4.1 m -83.26 92.22 7.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.185 -178.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.1 -31.46 67.81 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.33 0.586 . . . . 0.0 109.652 176.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.96 -31.81 72.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.185 176.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.567 ' HD1' ' HA ' ' A' ' 90' ' ' VAL . 22.8 t80 -73.23 -35.0 66.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.246 0.546 . . . . 0.0 109.836 176.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.63 -29.57 68.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.173 0.511 . . . . 0.0 110.463 174.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.1 tttt -66.74 -38.41 86.59 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 174.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.412 ' HG2' HG11 ' A' ' 95' ' ' VAL . 0.8 OUTLIER -61.55 -35.08 76.75 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.849 176.468 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.58 -11.59 60.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.53 -178.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.14 -35.04 6.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.137 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.15 -34.37 89.49 Favored Glycine 0 N--CA 1.451 -0.366 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 175.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.22 129.9 55.76 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 174.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.9 m -68.83 98.23 0.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -170.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 98.7 m -144.65 -178.16 5.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.031 -0.986 . . . . 0.0 108.595 174.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -101.17 150.41 22.97 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.191 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.5 -31.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.783 -177.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.5 -49.41 5.82 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.545 -0.836 . . . . 0.0 111.023 175.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.443 ' HB3' ' HA ' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -87.56 53.69 2.88 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.345 -0.428 . . . . 0.0 110.738 179.034 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.441 HD12 ' HA ' ' A' ' 32' ' ' ILE . 9.0 tp -108.68 139.52 30.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.936 0.398 . . . . 0.0 110.694 -179.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.777 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . . . -150.21 -178.74 6.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.348 0.594 . . . . 0.0 112.003 -177.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 48.8 t -133.16 134.41 44.1 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 171.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.447 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 99.3 m -106.53 145.08 32.3 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.018 0.437 . . . . 0.0 110.232 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.406 HD21 ' HB2' ' A' ' 40' ' ' GLU . 26.8 t30 -139.21 150.87 46.04 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.598 ' HB2' ' OE1' ' A' ' 40' ' ' GLU . 0.3 OUTLIER -42.71 139.08 2.11 Favored Pre-proline 0 CA--C 1.536 0.418 0 O-C-N 123.877 0.736 . . . . 0.0 112.434 179.807 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.461 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 20.3 Cg_endo -59.86 -40.61 61.43 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.561 2.841 . . . . 0.0 114.038 -171.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.76 -19.96 65.17 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.22 0.533 . . . . 0.0 111.661 -174.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.598 ' OE1' ' HB2' ' A' ' 37' ' ' SER . 45.3 mp0 -100.37 -39.83 7.79 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.064 -179.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 47.4 m -64.93 -35.49 81.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.641 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -104.04 15.7 27.94 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.862 -177.748 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -59.69 -25.59 64.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.986 -174.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 1.052 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 15.2 t70 -121.61 135.28 55.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.476 -177.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.77 -35.08 72.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.671 0.272 . . . . 0.0 111.315 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.424 ' HB3' ' OD2' ' A' ' 44' ' ' ASP . 2.6 tp -76.47 -40.52 50.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.99 0.424 . . . . 0.0 110.046 178.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 1.052 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 2.7 tp -56.74 -42.94 80.15 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.935 176.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.481 ' HA ' HD11 ' A' ' 51' ' ' LEU . 15.9 m -64.75 -9.14 18.07 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.176 -0.466 . . . . 0.0 112.213 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -108.95 -5.08 31.18 Favored Glycine 0 C--O 1.228 -0.235 0 N-CA-C 111.214 -0.754 . . . . 0.0 111.214 174.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.728 ' HG ' HD23 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -84.68 -25.81 28.19 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.546 -0.327 . . . . 0.0 111.287 -176.698 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.604 ' HG ' ' HB1' ' A' ' 66' ' ' ALA . 0.0 OUTLIER -77.4 1.23 19.64 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.448 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -146.52 85.81 0.17 Allowed Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.259 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.56 51.71 0.75 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.266 0.555 . . . . 0.0 110.872 178.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 171.11 -99.9 0.15 Allowed Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.42 ' O ' HG22 ' A' ' 102' ' ' THR . 0.7 OUTLIER -149.21 48.03 0.98 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.63 0.729 . . . . 0.0 109.621 176.159 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.691 HD13 ' HE3' ' A' ' 69' ' ' LYS . 0.2 OUTLIER -87.92 -178.89 6.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.139 -176.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.447 ' H ' HD23 ' A' ' 56' ' ' LEU . 1.1 t-20 -140.94 -176.37 4.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.033 -175.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.561 ' HA3' ' HA ' ' A' ' 66' ' ' ALA . . . -113.55 -118.66 3.46 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.289 -175.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.426 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -65.45 140.22 58.59 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.62 0.247 . . . . 0.0 110.338 179.409 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.566 ' HA ' ' CB ' ' A' ' 104' ' ' ASN . 64.2 m -62.85 89.89 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.368 -178.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.67 -36.42 4.26 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.947 -0.644 . . . . 0.0 112.738 177.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -91.08 101.98 14.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.026 0.441 . . . . 0.0 111.214 -176.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.72 93.54 3.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.993 179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 170.58 -54.28 0.19 Allowed Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.279 -0.729 . . . . 0.0 111.279 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.49 106.72 8.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 174.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.604 ' HB1' ' HG ' ' A' ' 51' ' ' LEU . . . -107.09 154.87 20.52 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.58 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 4.9 m -135.46 145.69 47.43 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -177.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 1.025 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -105.23 130.45 53.37 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.126 0.488 . . . . 0.0 110.454 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 1.047 ' HD3' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -84.3 161.78 20.32 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.585 -178.757 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.662 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -56.78 -36.3 69.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.743 0.306 . . . . 0.0 111.638 -178.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -64.86 -31.05 72.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.486 0.66 . . . . 0.0 110.123 178.38 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.506 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -79.67 -33.51 41.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.564 179.255 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.662 HD12 ' HA ' ' A' ' 70' ' ' ALA . 41.0 mt -66.49 -34.49 70.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.558 177.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -73.5 -40.2 64.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.688 175.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.405 ' HB2' ' O ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -76.54 -55.09 5.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -174.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.728 HD23 ' HG ' ' A' ' 50' ' ' LEU . 3.7 mp -109.85 -28.33 8.83 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.915 -0.314 . . . . 0.0 111.133 -173.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.402 ' HA2' ' O ' ' A' ' 73' ' ' ILE . . . 82.61 50.43 4.72 Favored Glycine 0 CA--C 1.516 0.15 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.526 173.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.538 ' HG ' HD23 ' A' ' 50' ' ' LEU . 4.7 mp -68.04 108.3 3.03 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.108 0.48 . . . . 0.0 111.546 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.511 ' HG ' ' H ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -90.69 12.06 20.24 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.887 178.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.04 -26.46 60.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.51 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 1.025 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -119.42 9.75 11.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.52 -175.627 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.4 t -104.62 136.56 37.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.757 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 28.3 t0 -117.13 168.99 9.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.072 0.463 . . . . 0.0 111.746 -176.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -56.96 147.47 23.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.405 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.455 HG21 ' C ' ' A' ' 88' ' ' GLY . 9.5 t -153.96 155.72 36.13 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.118 0.485 . . . . 0.0 111.752 -175.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.13 -0.55 15.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.554 0.692 . . . . 0.0 109.44 174.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.439 ' HB3' ' H ' ' A' ' 88' ' ' GLY . 7.6 tm-20 -115.0 -86.33 0.6 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.389 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.507 ' HA3' ' HA ' ' A' ' 15' ' ' SER . . . -141.89 155.04 25.23 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 172.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.407 ' N ' HG21 ' A' ' 85' ' ' THR . 82.2 Cg_exo -45.32 119.53 2.63 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.185 2.59 . . . . 0.0 112.094 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.567 ' HA ' ' HD1' ' A' ' 18' ' ' PHE . 1.6 m -120.04 179.85 1.95 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.722 -172.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 5.2 t -67.36 130.69 43.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.626 178.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.757 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttp -77.81 -30.43 51.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.578 -177.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -149.09 -89.07 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -171.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 4.9 mt -95.97 122.43 47.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.51 -169.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.428 HG23 ' HB3' ' A' ' 109' ' ' ASP . 0.0 OUTLIER -83.36 128.88 38.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.706 179.329 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.447 ' HB3' ' SG ' ' A' ' 35' ' ' CYS . . . -154.5 170.36 21.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.601 -178.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -115.31 124.0 50.17 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.978 0.418 . . . . 0.0 110.97 179.825 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 1.047 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 3.2 m -114.65 119.56 39.37 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.936 -178.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.473 ' O ' HD21 ' A' ' 56' ' ' LEU . 68.6 Cg_endo -75.5 139.74 23.36 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.327 2.018 . . . . 0.0 111.672 174.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.29 140.86 40.14 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 174.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 118.15 -91.99 0.53 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.634 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.42 HG22 ' O ' ' A' ' 55' ' ' LEU . 0.3 OUTLIER -141.17 179.32 6.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.674 0.273 . . . . 0.0 111.134 -175.261 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.494 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.2 OUTLIER 65.67 -167.59 0.21 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.383 -0.826 . . . . 0.0 113.045 174.455 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.566 ' CB ' ' HA ' ' A' ' 60' ' ' SER . 80.4 m-20 -98.03 173.3 7.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.656 0.741 . . . . 0.0 112.67 -162.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 29.2 m -112.28 141.71 45.66 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.1 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.4 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 0.9 OUTLIER -95.58 143.57 11.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 120.821 0.343 . . . . 0.0 110.344 178.369 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -105.34 115.29 30.01 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 8.9 p -91.24 0.53 8.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.753 0.787 . . . . 0.0 111.37 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . 0.428 ' HB3' HG23 ' A' ' 95' ' ' VAL . 28.9 t0 . . . . . 0 C--N 1.314 -0.956 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.857 175.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.71 ' HG ' ' OG ' ' A' ' 15' ' ' SER . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.233 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 72.35 -31.0 0.22 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.771 0.829 . . . . 0.0 111.634 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.447 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -149.12 -68.56 0.21 Allowed 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.753 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.71 ' OG ' ' HG ' ' A' ' 12' ' ' LEU . 2.3 m 67.3 -67.95 0.16 Allowed 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.427 0.691 . . . . 0.0 112.555 176.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.771 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . 56.8 -87.39 0.02 OUTLIER 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.421 0.688 . . . . 0.0 111.21 -175.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.458 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . . . -71.24 -35.77 71.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.876 0.37 . . . . 0.0 110.614 -179.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.497 ' HB2' HG12 ' A' ' 90' ' ' VAL . 19.9 t80 -70.52 -16.71 62.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.618 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.75 -15.45 59.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.963 0.411 . . . . 0.0 110.549 177.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.458 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 3.4 mttt -83.26 -24.35 32.31 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 175.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -32.45 72.91 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.241 176.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.27 -17.14 64.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.879 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -101.09 -50.54 3.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.602 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.83 -17.78 69.75 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.704 -178.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.5 m -119.67 134.94 55.02 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.36 97.49 9.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.964 0.412 . . . . 0.0 110.98 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -140.32 -178.19 5.37 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.419 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -120.91 172.2 8.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.568 0.223 . . . . 0.0 110.94 -175.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.408 HG13 ' N ' ' A' ' 30' ' ' GLY . 14.5 p -61.77 -45.58 98.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.76 -175.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.408 ' N ' HG13 ' A' ' 29' ' ' VAL . . . -100.62 20.01 50.04 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.771 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 1.2 m -125.98 -5.58 6.79 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.552 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -80.09 126.45 39.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.573 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -148.25 160.31 43.08 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.291 0.567 . . . . 0.0 111.966 -170.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 m -114.58 139.23 49.77 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.428 174.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.414 ' HB3' ' HB ' ' A' ' 94' ' ' ILE . 0.5 OUTLIER -124.62 160.16 29.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.838 0.351 . . . . 0.0 110.853 -176.591 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -145.74 160.03 42.31 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.758 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -51.4 150.69 6.12 Favored Pre-proline 0 CA--C 1.536 0.44 0 O-C-N 123.549 0.531 . . . . 0.0 111.321 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 47.2 Cg_exo -53.47 -49.02 18.82 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.082 2.521 . . . . 0.0 113.3 -171.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.06 -11.41 60.94 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -174.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' A' ' 43' ' ' ASN . 0.1 OUTLIER -103.27 -43.85 5.33 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.085 0.469 . . . . 0.0 110.035 179.881 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.826 HG21 ' H ' ' A' ' 66' ' ' ALA . 0.6 OUTLIER -65.84 -34.28 77.8 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.147 176.104 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.661 HD22 HG22 ' A' ' 41' ' ' THR . 1.2 m-80 -104.16 14.69 29.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.312 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.429 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 4.5 t-20 -47.58 -38.7 14.95 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.537 -176.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.642 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 9.8 t70 -113.2 142.18 46.09 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.0 -35.21 74.54 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.231 0.332 . . . . 0.0 111.149 -179.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.37 -32.33 58.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.921 0.391 . . . . 0.0 109.954 178.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.642 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.6 OUTLIER -61.72 -39.36 91.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.522 -179.128 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.66 ' HA ' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -58.22 -31.38 67.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.478 179.505 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -84.13 -30.31 28.68 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.911 178.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.422 ' HG ' HD13 ' A' ' 76' ' ' LEU . 1.4 mp -69.28 -20.93 63.91 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.815 0.34 . . . . 0.0 111.096 -178.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.66 HD12 ' HA ' ' A' ' 48' ' ' SER . 3.3 mt -74.01 -14.1 60.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.532 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.666 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -126.97 76.42 0.4 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.599 -0.81 . . . . 0.0 111.621 -177.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.91 -20.35 33.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.969 0.414 . . . . 0.0 110.798 -176.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -139.01 68.23 0.5 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.509 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 mt 53.03 45.89 27.86 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.389 0.614 . . . . 0.0 111.112 177.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.666 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -84.73 161.19 20.11 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.351 -177.305 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.588 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 30.8 t-20 -126.08 -177.68 4.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.875 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -100.03 -152.77 26.9 Favored Glycine 0 C--O 1.225 -0.444 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.009 -176.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.818 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -70.35 146.37 50.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.979 0.419 . . . . 0.0 110.864 179.938 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.4 m -59.23 98.04 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.516 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.39 4.89 65.79 Favored Glycine 0 C--O 1.229 -0.203 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.424 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.818 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 18.8 t30 -128.93 100.56 5.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.181 0.515 . . . . 0.0 110.796 -177.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.19 71.85 9.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.282 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -166.21 -61.71 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.981 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.71 113.44 18.9 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.023 0.439 . . . . 0.0 110.973 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.826 ' H ' HG21 ' A' ' 41' ' ' THR . . . -107.53 153.71 22.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.216 173.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.604 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 0.1 OUTLIER -126.53 141.04 52.0 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.538 -175.5 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.922 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -105.41 128.6 53.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.333 0.587 . . . . 0.0 110.043 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.65 ' HG2' ' HB2' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -76.83 170.17 16.96 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.724 -176.808 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.482 ' HB2' HD22 ' A' ' 12' ' ' LEU . . . -60.55 -27.74 67.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.879 0.371 . . . . 0.0 111.308 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.55 -31.11 63.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.945 0.879 . . . . 0.0 109.071 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.65 ' HB2' ' HG2' ' A' ' 69' ' ' LYS . 0.5 OUTLIER -80.96 -27.07 36.16 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.277 178.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 69' ' ' LYS . 23.8 mm -64.6 -42.77 96.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.724 176.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -20.57 63.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.385 177.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.474 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -70.38 -53.83 14.96 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.504 -177.075 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.422 HD13 ' HG ' ' A' ' 50' ' ' LEU . 0.7 OUTLIER -136.95 -5.92 1.89 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -171.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.44 51.92 7.01 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 119.799 -1.191 . . . . 0.0 112.12 -178.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.408 ' O ' HG23 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -62.36 83.68 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.968 0.413 . . . . 0.0 111.781 -176.962 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.416 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -71.91 4.85 3.01 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -175.191 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.63 -23.13 42.82 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -175.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.922 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -125.57 -4.47 7.16 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.22 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.509 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -115.94 138.22 47.09 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.525 0 CA-C-O 121.513 0.673 . . . . 0.0 111.789 -177.382 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.859 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 21.7 t70 -112.96 153.44 28.02 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.962 -1.017 . . . . 0.0 108.578 176.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -117.65 103.33 9.93 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.998 -174.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 78.3 p -104.75 -168.69 1.51 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.396 175.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.401 ' HG2' ' H ' ' A' ' 86' ' ' GLU . 0.4 OUTLIER -66.03 -25.32 67.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.771 0.32 . . . . 0.0 111.043 179.521 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.771 ' HB3' ' HB3' ' A' ' 16' ' ' ALA . 2.5 mp0 -71.54 -32.01 67.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.286 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 130.2 -146.1 17.2 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.481 -0.866 . . . . 0.0 111.794 -178.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -74.76 108.7 2.76 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.958 2.439 . . . . 0.0 111.346 175.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.497 HG12 ' HB2' ' A' ' 18' ' ' PHE . 0.6 OUTLIER -122.41 162.51 22.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.05 -179.231 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -67.27 124.17 22.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.941 0.401 . . . . 0.0 110.52 -177.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.859 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 2.4 tttp -70.83 -24.0 62.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.827 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.444 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -152.8 -95.18 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.14 -174.343 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.444 HG13 ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -92.81 136.77 23.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.597 -173.024 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -97.61 129.23 48.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 172.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -140.8 163.8 31.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.921 0.391 . . . . 0.0 111.363 -174.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.84 109.08 19.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.159 177.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.771 ' O ' ' HA ' ' A' ' 31' ' ' SER . 64.1 m -110.87 116.79 51.51 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.505 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.0 132.9 14.56 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.273 1.982 . . . . 0.0 111.934 177.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.12 120.18 23.28 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.086 176.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.5 ' O ' ' HB ' ' A' ' 102' ' ' THR . . . 137.87 -52.01 0.76 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.077 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.5 ' HB ' ' O ' ' A' ' 101' ' ' GLY . 5.1 t 176.33 177.52 0.24 Allowed 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.506 -0.183 . . . . 0.0 110.506 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 76.34 157.75 0.19 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.023 0.929 . . . . 0.0 112.517 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.588 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.3 OUTLIER -75.08 175.52 8.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.818 -175.023 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 10.9 m -112.11 141.9 45.22 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.884 -178.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.7 m -91.88 138.94 18.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.616 174.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.7 128.93 44.73 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -94.61 7.03 6.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.591 0.71 . . . . 0.0 110.781 -178.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.6 t70 . . . . . 0 C--N 1.315 -0.933 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.38 172.558 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.459 HD22 ' HA ' ' A' ' 12' ' ' LEU . 1.0 OUTLIER . . . . . 0 CA--C 1.53 0.209 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.98 -41.37 64.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.161 0.505 . . . . 0.0 110.5 -178.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.21 6.39 8.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.901 -178.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.519 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 15.2 m -72.92 -25.78 61.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.14 174.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.94 -53.51 0.51 Allowed 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.906 0.754 . . . . 0.0 111.354 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.542 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . . . -63.1 -33.01 74.54 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.858 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.605 ' HE2' ' SG ' ' A' ' 34' ' ' CYS . 15.9 t80 -72.14 -28.46 63.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.151 177.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.33 -22.32 63.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.748 177.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.542 ' HE2' ' HA ' ' A' ' 17' ' ' ALA . 55.4 mttm -67.63 -29.58 68.94 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.82 -31.91 73.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.639 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.13 -18.63 63.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.526 -177.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -108.66 -25.1 11.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.783 179.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -77.13 -26.43 61.97 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.319 179.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.769 HG21 HG21 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -137.99 155.44 48.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.666 0.269 . . . . 0.0 110.433 -179.649 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.16 95.73 9.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.198 0.523 . . . . 0.0 110.414 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -148.44 132.25 17.01 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.642 175.908 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -80.38 173.71 12.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.318 -177.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.8 p -55.78 -41.76 67.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 120.751 0.31 . . . . 0.0 111.356 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -95.36 12.36 68.02 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.295 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.576 ' HA ' ' HA ' ' A' ' 99' ' ' PRO . 0.7 OUTLIER -130.68 16.35 5.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.949 0.404 . . . . 0.0 110.637 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -106.49 133.14 51.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 175.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.509 ' CB ' ' HB3' ' A' ' 98' ' ' CYS . . . -150.45 178.97 8.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.503 0.668 . . . . 0.0 112.319 -171.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.605 ' SG ' ' HE2' ' A' ' 18' ' ' PHE . 3.8 m -127.45 135.07 49.9 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.792 -1.095 . . . . 0.0 108.806 171.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.551 ' HB3' ' HB ' ' A' ' 94' ' ' ILE . 0.4 OUTLIER -110.92 158.41 18.77 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.111 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.643 ' OD1' ' HB3' ' A' ' 40' ' ' GLU . 11.0 t-20 -148.96 159.24 44.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.679 0.276 . . . . 0.0 110.843 -172.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.465 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -50.61 132.71 27.13 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.528 177.489 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 37' ' ' SER . 63.8 Cg_exo -53.38 -43.3 58.63 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.31 2.673 . . . . 0.0 113.42 -177.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.09 -8.12 52.82 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.969 0.414 . . . . 0.0 111.029 -177.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.643 ' HB3' ' OD1' ' A' ' 36' ' ' ASN . 1.5 tt0 -103.47 -46.81 4.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.563 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 43.8 m -60.18 -38.12 82.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.978 176.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.403 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -102.41 14.74 31.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.006 -177.541 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -62.4 -42.02 99.11 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.144 -177.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 1.046 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 21.7 t70 -87.57 140.88 29.07 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.531 178.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.26 -40.24 89.62 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.825 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.62 -19.73 22.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.046 -175.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 1.046 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -57.24 -35.64 69.96 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.209 -179.729 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.42 -23.32 67.35 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.87 0.366 . . . . 0.0 111.386 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -100.7 -19.07 18.83 Favored Glycine 0 C--N 1.33 0.229 0 N-CA-C 111.283 -0.727 . . . . 0.0 111.283 174.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.606 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 2.3 tp -64.34 -35.06 79.65 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 122.596 0.359 . . . . 0.0 110.904 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.57 ' HB2' HD22 ' A' ' 56' ' ' LEU . 0.2 OUTLIER -72.43 -34.55 67.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.172 0.511 . . . . 0.0 110.637 178.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.21 53.37 4.76 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.568 -175.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.79 -27.48 61.16 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.4 0.619 . . . . 0.0 110.527 178.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -137.9 -94.28 0.33 Allowed Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.519 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.58 ' HB3' ' HA2' ' A' ' 101' ' ' GLY . 0.5 OUTLIER -130.23 58.82 1.65 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.94 0.4 . . . . 0.0 110.027 178.448 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.57 HD22 ' HB2' ' A' ' 51' ' ' LEU . 0.5 OUTLIER -80.81 103.1 10.43 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.59 0.71 . . . . 0.0 110.146 177.885 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.689 HD22 ' HA ' ' A' ' 104' ' ' ASN . 2.2 p-10 -89.99 171.4 9.6 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 114.47 -1.241 . . . . 0.0 109.375 175.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.31 -160.12 34.3 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.581 -0.819 . . . . 0.0 113.168 -174.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.479 ' HA ' HD23 ' A' ' 59' ' ' LEU . 0.8 OUTLIER -67.98 159.33 30.88 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 122.545 0.338 . . . . 0.0 111.671 -178.303 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.586 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 0.4 OUTLIER -55.04 87.23 0.01 OUTLIER 'General case' 0 C--O 1.233 0.187 0 C-N-CA 123.841 0.856 . . . . 0.0 111.918 178.909 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.77 8.05 84.99 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.514 178.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -120.5 102.38 8.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.976 0.417 . . . . 0.0 111.509 -178.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.37 104.17 5.82 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.51 176.029 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 157.37 -61.38 0.33 Allowed Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.178 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.85 119.88 21.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.902 0.382 . . . . 0.0 110.073 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -114.27 135.83 53.64 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.197 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.07 132.36 56.68 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.882 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -103.78 129.32 51.18 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.055 0.455 . . . . 0.0 110.305 -177.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.474 ' HG3' ' HG2' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -75.63 168.03 20.79 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.323 -177.023 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.87 -31.88 67.13 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.678 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.6 -35.44 73.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.261 0.553 . . . . 0.0 109.541 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.696 HD12 HD11 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -76.89 -32.49 57.47 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.294 178.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.1 mt -60.81 -38.3 78.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.579 176.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.54 -24.47 49.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.033 177.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.408 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -77.04 -53.67 7.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.26 -0.427 . . . . 0.0 112.077 -175.406 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.606 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.9 OUTLIER -117.41 -24.43 7.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -172.9 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.89 50.59 6.85 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 119.974 -1.108 . . . . 0.0 112.367 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.696 HD11 HD12 ' A' ' 72' ' ' LEU . 2.4 mp -74.86 92.85 2.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.946 0.403 . . . . 0.0 110.735 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -77.46 6.51 6.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.713 -177.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.87 -44.86 79.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.236 0.541 . . . . 0.0 110.379 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.882 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -94.74 2.83 55.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.231 -176.808 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 16.3 t -115.22 138.29 46.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.234 0.54 . . . . 0.0 110.826 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.658 ' HB2' ' HD3' ' A' ' 92' ' ' LYS . 31.7 t0 -128.97 164.69 22.62 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 175.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -110.23 135.81 50.41 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.081 0.467 . . . . 0.0 111.513 -176.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.1 p -120.92 -169.51 1.84 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.343 176.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -66.93 -32.49 73.78 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.745 0.653 . . . . 0.0 109.941 174.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.519 ' HB3' ' O ' ' A' ' 15' ' ' SER . 0.5 OUTLIER -72.93 -54.81 7.72 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.873 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 166.43 -152.13 20.93 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.253 -0.975 . . . . 0.0 112.403 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -70.09 120.75 7.43 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 123.001 2.467 . . . . 0.0 111.022 174.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.4 -175.16 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.948 0.404 . . . . 0.0 111.064 -174.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.51 125.27 26.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.791 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.658 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 14.3 tptm -68.89 -41.46 78.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.82 -177.194 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -146.68 -63.36 0.3 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.575 -172.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.551 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 2.2 mt -109.19 122.15 63.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.99 0.424 . . . . 0.0 111.718 -173.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -85.46 126.92 40.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.806 175.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -154.29 152.58 30.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.303 -176.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 6.9 m -104.17 107.87 18.97 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 176.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.509 ' HB3' ' CB ' ' A' ' 33' ' ' ALA . 53.9 t -119.66 117.25 32.79 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.571 -173.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.66 ' HG2' HG21 ' A' ' 102' ' ' THR . 3.1 Cg_exo -80.01 154.8 22.76 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.047 2.498 . . . . 0.0 111.944 175.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.474 ' HG2' ' HG3' ' A' ' 69' ' ' LYS . 0.9 OUTLIER -88.27 100.89 13.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 171.885 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.58 ' HA2' ' HB3' ' A' ' 55' ' ' LEU . . . 110.73 68.42 0.57 Allowed Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.217 -0.992 . . . . 0.0 112.53 -178.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.66 HG21 ' HG2' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -146.28 -177.8 5.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.746 0.308 . . . . 0.0 111.081 -178.406 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 14.1 m -82.23 -47.88 11.92 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 172.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.689 ' HA ' HD22 ' A' ' 57' ' ' ASN . 18.0 p30 -154.63 163.69 39.86 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.138 174.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.509 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 34.7 m -112.34 141.99 45.4 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -97.25 132.21 42.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.184 0.516 . . . . 0.0 111.499 -172.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.45 130.97 35.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.503 173.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.769 HG21 HG21 ' A' ' 25' ' ' THR . 0.0 OUTLIER -108.98 25.13 2.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.938 -172.424 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 . . . . . 0 C--N 1.324 -0.531 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.501 179.498 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.497 ' C ' ' H ' ' A' ' 14' ' ' THR . 6.3 mp . . . . . 0 CA--C 1.527 0.096 0 CA-C-O 120.523 0.201 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 69.26 -32.28 0.22 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.968 0.907 . . . . 0.0 111.774 -178.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.497 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -156.51 -57.42 0.09 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 47.6 46.78 17.86 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.189 -178.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.09 -62.02 2.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.943 0.401 . . . . 0.0 111.441 -173.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.11 -25.47 55.45 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.958 0.408 . . . . 0.0 110.76 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -64.66 -38.26 90.41 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.419 178.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.92 -19.92 64.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.492 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.88 -30.08 63.68 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -72.6 -26.16 61.59 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.289 176.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.0 -5.55 44.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.79 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -81.01 -21.36 40.27 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.151 0.501 . . . . 0.0 110.18 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.78 -27.71 49.51 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.703 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.415 ' OG1' HG11 ' A' ' 108' ' ' VAL . 0.3 OUTLIER -141.39 113.17 7.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.865 0.364 . . . . 0.0 110.942 -179.674 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.9 m -68.66 113.38 6.1 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.925 175.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.469 ' HB3' HG13 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -148.6 161.77 41.03 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.698 178.414 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.443 ' H ' ' HB2' ' A' ' 31' ' ' SER . 17.0 t-20 -87.44 171.49 10.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.777 -176.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.8 m -63.86 -36.81 77.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.831 0.348 . . . . 0.0 110.599 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -92.39 25.29 18.7 Favored Glycine 0 N--CA 1.451 -0.326 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 175.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.494 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 1.4 m -142.79 -9.19 0.81 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.069 0.462 . . . . 0.0 110.523 177.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.469 HG13 ' HB3' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -94.81 133.79 34.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 177.596 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.639 ' HB2' ' HG3' ' A' ' 69' ' ' LYS . . . -148.59 165.54 30.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.459 0.647 . . . . 0.0 112.625 -171.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.4 t -124.5 144.51 50.06 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.798 -1.092 . . . . 0.0 109.309 173.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.584 ' HB3' HG12 ' A' ' 94' ' ' ILE . 0.1 OUTLIER -124.41 155.53 38.67 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.771 0.319 . . . . 0.0 110.402 -179.311 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.424 HD22 ' HB2' ' A' ' 40' ' ' GLU . 1.6 t30 -134.59 159.49 41.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.737 178.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.38 142.9 67.58 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.789 178.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.415 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 74.2 Cg_exo -51.49 -33.04 45.73 Favored 'Trans proline' 0 N--CA 1.478 0.567 0 C-N-CA 123.797 2.998 . . . . 0.0 113.847 -174.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.83 -7.65 23.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.023 0.439 . . . . 0.0 111.56 -178.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.424 ' HB2' HD22 ' A' ' 36' ' ' ASN . 1.1 mt-10 -113.38 -39.98 3.98 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.202 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.19 -33.32 75.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.44 0.638 . . . . 0.0 110.61 176.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 2.2 m-80 -102.92 14.05 32.87 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.274 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -66.34 -28.95 69.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.614 -176.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.94 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 7.3 t0 -115.06 140.86 48.71 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.871 177.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -26.3 66.0 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.991 0.424 . . . . 0.0 110.745 177.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.466 ' HA ' HD13 ' A' ' 46' ' ' LEU . 1.0 OUTLIER -86.0 -24.0 26.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.175 177.756 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.94 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -62.12 -42.63 99.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.249 -177.436 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.591 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -65.38 -26.97 68.23 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.708 -175.562 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.84 -21.35 33.9 Favored Glycine 0 C--N 1.329 0.151 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.349 174.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.753 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 1.2 tp -70.72 -35.82 72.9 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.473 -0.363 . . . . 0.0 110.564 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.591 HD21 ' HA ' ' A' ' 48' ' ' SER . 1.6 pp -74.15 -26.13 60.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.241 -178.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.95 58.01 2.88 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.696 -177.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.701 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -79.55 59.61 3.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.075 0.464 . . . . 0.0 111.575 -176.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 120.22 70.14 0.31 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.615 176.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 15.0 mt 56.59 32.55 21.14 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.351 0.596 . . . . 0.0 111.363 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.88 145.0 31.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.099 -177.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.686 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 4.6 t-20 -120.68 -178.24 3.67 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.416 ' HA3' ' HA ' ' A' ' 66' ' ' ALA . . . -116.3 -122.7 3.44 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.521 -0.847 . . . . 0.0 112.245 -175.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.963 HD23 ' HB2' ' A' ' 65' ' ' SER . 1.8 mm? -65.31 144.09 57.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.683 0.277 . . . . 0.0 110.726 -179.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.58 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -58.17 94.16 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.813 -179.793 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.42 -8.02 79.51 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 121.125 -0.56 . . . . 0.0 113.237 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -105.57 141.46 36.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.446 0.641 . . . . 0.0 111.583 -175.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -104.37 136.37 44.08 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.78 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 112.74 -39.29 2.91 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.886 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.963 ' HB2' HD23 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -97.46 116.22 29.25 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.592 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.453 ' HB1' HD13 ' A' ' 51' ' ' LEU . . . -128.32 150.81 49.91 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.491 -178.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -129.97 146.72 51.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.673 0.273 . . . . 0.0 110.932 -177.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.516 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -114.83 155.21 27.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.156 178.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.639 ' HG3' ' HB2' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -100.44 174.85 5.91 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.814 -173.545 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.452 ' O ' ' HB ' ' A' ' 73' ' ' ILE . . . -61.3 -39.34 90.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.111 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.5 -36.42 83.79 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.979 0.418 . . . . 0.0 110.488 177.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.701 HD11 ' HB3' ' A' ' 53' ' ' ALA . 1.2 tp -72.88 -21.85 60.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.844 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.452 ' HB ' ' O ' ' A' ' 70' ' ' ALA . 0.2 OUTLIER -60.43 -40.22 83.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.874 176.369 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -88.27 2.17 52.96 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.317 0.58 . . . . 0.0 110.736 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.66 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.4 OUTLIER -94.23 -53.66 3.86 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.062 -177.861 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.753 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.8 OUTLIER -121.02 -16.05 8.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 -174.246 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.77 49.09 45.0 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.326 -0.94 . . . . 0.0 112.075 -179.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.44 ' H ' HD12 ' A' ' 78' ' ' LEU . 0.7 OUTLIER -76.72 98.47 4.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.905 0.383 . . . . 0.0 111.272 -176.194 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 3.82 11.3 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.406 179.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.46 -41.11 80.67 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -177.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.516 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -116.83 4.0 12.94 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -174.097 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.4 t -111.18 136.71 46.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.292 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.717 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 5.5 t0 -119.33 168.19 11.17 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -129.97 99.1 4.97 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.936 0.398 . . . . 0.0 111.189 -177.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 41.4 p -96.88 -169.09 1.81 Allowed 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 173.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -81.87 8.22 10.88 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.313 0.578 . . . . 0.0 110.081 175.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -104.74 4.29 32.24 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.645 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 99.69 -161.24 19.55 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.139 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -65.2 116.9 4.12 Favored 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.853 2.369 . . . . 0.0 111.237 173.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.5 m -134.19 177.78 6.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.04 0.448 . . . . 0.0 111.717 -172.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.7 130.89 44.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.473 177.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.717 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttm -82.38 -32.89 28.96 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.884 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -141.8 -94.55 0.13 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.768 -174.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.584 HG12 ' HB3' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -107.0 147.73 11.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.015 0.436 . . . . 0.0 111.217 -172.748 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.439 HG13 HG12 ' A' ' 108' ' ' VAL . 3.3 p -100.66 139.55 21.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.431 -179.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.49 160.67 41.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.001 0.429 . . . . 0.0 111.694 -175.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 1.3 m -104.89 107.73 18.86 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 174.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.689 ' HA ' ' HB3' ' A' ' 105' ' ' CYS . 9.9 t -124.62 108.47 28.79 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.901 -169.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.532 ' HD2' ' SG ' ' A' ' 105' ' ' CYS . 56.9 Cg_endo -69.47 126.71 13.83 Favored 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 122.633 2.222 . . . . 0.0 112.568 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.17 104.43 6.69 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 164.11 -67.46 0.22 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.399 -0.905 . . . . 0.0 112.687 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -161.59 159.13 27.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.751 0.276 . . . . 0.0 111.353 -177.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.563 HG22 ' H ' ' A' ' 104' ' ' ASN . 1.3 m 72.53 166.95 0.31 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.584 0.707 . . . . 0.0 112.699 171.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.686 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.4 OUTLIER -74.46 163.5 27.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.312 -172.036 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.689 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 9.3 m -120.34 144.59 47.78 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.941 -175.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -90.66 148.31 4.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.482 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.52 140.39 43.36 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.497 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.439 HG12 HG13 ' A' ' 95' ' ' VAL . 0.8 OUTLIER -100.98 -0.26 10.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.512 0.672 . . . . 0.0 111.051 -178.341 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . 0.414 ' OD2' ' HB ' ' A' ' 94' ' ' ILE . 1.9 t70 . . . . . 0 C--N 1.317 -0.809 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.284 176.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.53 0.2 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.14 -32.18 38.95 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.631 -177.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.73 5.11 4.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.863 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 87' ' ' GLU . 94.5 p -80.97 -34.33 33.2 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.09 -53.22 0.47 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.914 0.886 . . . . 0.0 111.27 -175.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.66 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . . . -66.82 -24.55 66.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.77 -177.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.631 ' HB2' HG12 ' A' ' 90' ' ' VAL . 36.3 t80 -87.9 -25.99 22.96 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.17 174.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.43 -40.21 93.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.272 178.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.66 ' HD3' ' HA ' ' A' ' 17' ' ' ALA . 0.0 OUTLIER -69.54 -24.51 63.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.462 0.649 . . . . 0.0 109.815 176.599 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.615 HE21 ' HA ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -74.63 -34.01 62.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.05 177.58 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.68 ' HB1' HD11 ' A' ' 32' ' ' ILE . . . -67.78 -18.51 64.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.758 -177.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -87.05 -1.14 57.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.984 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -73.98 -26.37 69.09 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.069 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.56 172.32 13.06 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.99 96.9 1.36 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.986 0.422 . . . . 0.0 109.936 173.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 66.7 m -130.49 134.59 47.2 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.85 -175.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -145.45 -163.08 1.64 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.463 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 p -61.96 135.23 26.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.996 0.427 . . . . 0.0 110.121 177.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.93 -8.19 4.82 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 120.964 -0.636 . . . . 0.0 113.226 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -114.1 -6.35 13.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.952 0.405 . . . . 0.0 110.698 179.936 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.68 HD11 ' HB1' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -91.68 128.79 43.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.84 177.2 10.03 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.063 0.458 . . . . 0.0 111.707 -174.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.3 m -140.54 147.47 39.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.625 173.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -128.33 160.27 32.71 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.238 0.542 . . . . 0.0 111.039 -176.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 42.6 t-20 -153.78 159.98 42.09 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.129 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -48.58 137.88 12.13 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 123.636 0.585 . . . . 0.0 111.452 177.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.589 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 10.0 Cg_endo -52.91 -35.21 69.88 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.281 2.654 . . . . 0.0 112.94 -179.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.44 -19.88 62.47 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.82 0.343 . . . . 0.0 111.735 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -91.92 -52.45 4.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.136 0.493 . . . . 0.0 110.018 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.552 ' O ' ' HB3' ' A' ' 47' ' ' LEU . 1.2 t -69.99 -21.05 63.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.643 -177.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.589 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -105.94 7.46 32.1 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.478 -179.043 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -66.8 -34.49 77.93 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.323 0.582 . . . . 0.0 110.704 -178.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 1.099 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 13.3 t0 -96.37 134.68 39.22 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.216 177.479 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.19 -24.82 68.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.815 0.341 . . . . 0.0 111.244 -179.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.2 tp -91.76 -22.08 20.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.935 0.398 . . . . 0.0 110.831 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 1.099 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -66.08 -31.68 72.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.007 -177.144 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.593 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -67.94 -14.52 63.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.243 -179.052 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -104.82 -20.03 10.37 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.598 173.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.463 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 1.1 mp -73.35 -22.37 60.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.889 0.376 . . . . 0.0 111.185 -177.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.593 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.3 OUTLIER -75.63 -12.55 60.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.327 -178.737 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.434 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -138.27 86.53 0.22 Allowed Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.561 -178.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.59 ' HB2' HD21 ' A' ' 72' ' ' LEU . . . -65.37 -21.69 66.71 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -177.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.59 67.12 0.37 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.353 -0.927 . . . . 0.0 113.044 179.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 mp 61.49 40.89 13.28 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.157 0.503 . . . . 0.0 111.74 173.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.451 HD11 ' H ' ' A' ' 101' ' ' GLY . 0.1 OUTLIER -72.86 172.45 10.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.414 -178.371 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -117.03 -177.83 3.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.86 -176.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -116.34 -151.49 9.65 Favored Glycine 0 C--O 1.228 -0.271 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.209 -175.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.415 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -66.43 134.75 53.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.839 0.352 . . . . 0.0 110.308 177.958 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.48 105.78 1.01 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.798 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 102.15 -38.7 3.06 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.453 176.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -95.98 102.87 14.72 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.666 0.27 . . . . 0.0 110.653 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.15 71.38 2.89 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.015 0.436 . . . . 0.0 111.103 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -160.83 -58.76 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.012 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.18 139.62 44.57 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.877 0.37 . . . . 0.0 111.158 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.31 131.68 48.65 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 m -115.71 131.69 56.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.103 0.477 . . . . 0.0 110.688 -176.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -104.37 144.0 32.24 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.849 -177.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.731 ' HG3' ' HG2' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -89.82 161.26 16.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.49 -174.088 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.595 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -58.38 -25.64 62.28 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -175.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.86 -27.15 60.14 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.808 0.813 . . . . 0.0 109.005 -177.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.59 HD21 ' HB2' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -90.93 -17.12 26.94 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.306 -178.461 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.616 HG12 HG21 ' A' ' 82' ' ' VAL . 1.3 mt -66.15 -39.42 84.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.3 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.22 7.91 20.32 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.126 0.489 . . . . 0.0 110.731 177.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.504 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.8 OUTLIER -88.27 -53.41 4.71 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.763 -179.31 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.2 0.83 2.88 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -173.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.78 52.98 4.16 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 119.718 -1.229 . . . . 0.0 113.055 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.492 ' O ' HG23 ' A' ' 82' ' ' VAL . 4.5 mm? -67.97 66.56 0.1 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 122.663 0.385 . . . . 0.0 111.849 -178.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.34 -4.87 28.49 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -175.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.48 -31.23 42.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.76 0.314 . . . . 0.0 111.623 -176.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.0 mt -102.81 -21.95 13.96 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.955 0.407 . . . . 0.0 111.177 -174.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.616 HG21 HG12 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -110.28 138.17 39.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.196 178.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.695 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 16.5 t0 -110.78 158.66 18.42 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.748 176.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -116.28 116.33 27.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.257 0.551 . . . . 0.0 111.575 -177.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.5 p -107.94 -175.47 2.79 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.397 -0.82 . . . . 0.0 108.873 174.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -66.12 -27.74 68.28 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.805 0.336 . . . . 0.0 111.448 -177.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 15' ' ' SER . 1.1 pm0 -70.65 -39.59 73.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.032 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 151.62 -159.79 28.45 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.108 -178.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -71.57 122.31 8.48 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 123.056 2.504 . . . . 0.0 111.286 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.631 HG12 ' HB2' ' A' ' 18' ' ' PHE . 1.5 m -138.51 169.83 17.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.76 -175.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.56 127.21 31.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.724 0.297 . . . . 0.0 110.481 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.695 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 2.0 tttt -67.36 -64.45 0.85 Allowed 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.082 -173.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.48 -61.8 1.37 Allowed 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.512 -172.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.9 mt -108.83 119.24 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.107 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.4 p -79.85 112.05 17.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.416 0.627 . . . . 0.0 109.831 175.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -151.02 137.69 18.83 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.068 -176.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 1.2 m -104.66 149.87 25.19 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.975 0.417 . . . . 0.0 110.482 -176.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 31' ' ' SER . 7.2 t -148.08 136.35 11.25 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.079 -167.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -81.95 152.19 16.62 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.701 2.267 . . . . 0.0 111.927 178.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.731 ' HG2' ' HG3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -89.43 157.24 18.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.864 0.364 . . . . 0.0 110.094 175.532 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.451 ' H ' HD11 ' A' ' 56' ' ' LEU . . . 96.87 -56.31 1.32 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.068 -0.587 . . . . 0.0 111.99 -178.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.7 t -177.97 -173.77 0.4 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.7 m 74.75 148.66 0.1 Allowed 'General case' 0 C--N 1.33 -0.251 0 O-C-N 123.849 0.718 . . . . 0.0 111.195 -177.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -74.29 174.6 8.59 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.467 -175.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.98 146.82 34.61 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.894 177.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -102.05 138.44 26.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.853 0.359 . . . . 0.0 110.356 -177.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -110.48 108.32 18.28 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 4.9 p -74.88 -4.15 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.735 0.779 . . . . 0.0 111.622 -173.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.311 -1.105 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.41 179.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.505 ' HG ' HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.83 -30.83 71.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.923 0.392 . . . . 0.0 111.239 -179.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.31 -17.15 56.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.407 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.15 74.43 6.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.43 179.129 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.65 -40.14 62.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.549 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.58 -31.0 71.04 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.893 -177.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.559 ' HB2' HG12 ' A' ' 90' ' ' VAL . 88.8 t80 -70.18 -43.95 69.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.118 0.485 . . . . 0.0 110.111 -179.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.22 -30.24 48.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.366 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -63.3 -35.46 80.43 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.664 0.745 . . . . 0.0 109.237 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -30.43 67.17 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.526 176.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.56 -8.54 56.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.649 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.89 -5.62 59.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.031 0.443 . . . . 0.0 110.273 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.24 -9.16 55.93 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.156 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.5 m -134.57 152.78 52.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.82 95.58 7.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.14 0.495 . . . . 0.0 111.655 -177.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.497 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -140.95 155.91 46.16 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 173.206 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -112.85 -179.32 3.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.533 0.206 . . . . 0.0 110.481 -174.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.1 m -60.38 138.07 21.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 176.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 80.11 -13.84 24.12 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.321 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.693 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -104.93 -2.94 23.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.79 0.295 . . . . 0.0 111.228 179.556 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.418 ' H ' HG12 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -81.26 106.12 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 176.9 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.658 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -122.25 144.92 48.68 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.991 0.424 . . . . 0.0 111.649 -173.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 5.5 t -107.98 133.37 52.4 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.519 174.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.716 ' HB2' ' HB ' ' A' ' 94' ' ' ILE . 37.5 m -112.68 149.66 32.58 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.51 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.496 ' HB2' HD23 ' A' ' 81' ' ' LEU . 38.1 t-20 -136.56 152.8 50.89 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 174.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m -45.8 133.8 6.6 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 123.485 0.49 . . . . 0.0 110.884 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.4 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 6.3 Cg_endo -47.02 -44.92 22.25 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 124.043 3.162 . . . . 0.0 114.351 -172.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.1 -11.24 60.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.952 0.406 . . . . 0.0 111.835 -176.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.92 -38.66 6.91 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.558 HG23 HD13 ' A' ' 47' ' ' LEU . 1.4 m -60.26 -43.12 96.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.21 173.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.4 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.6 OUTLIER -90.01 5.88 44.68 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.192 -176.564 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -81.19 -7.61 59.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.427 0.632 . . . . 0.0 109.646 175.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -96.34 144.16 26.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.349 177.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -82.32 -21.68 35.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.329 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.545 ' HB3' HD11 ' A' ' 78' ' ' LEU . 3.2 mp -82.06 -52.86 6.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.619 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.784 ' HA ' ' HB3' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -54.05 -36.62 63.28 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.935 179.994 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 t -58.75 -25.23 62.79 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.401 -178.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -105.72 -24.06 7.19 Favored Glycine 0 C--N 1.334 0.422 0 N-CA-C 111.534 -0.627 . . . . 0.0 111.534 173.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.784 ' HB3' ' HA ' ' A' ' 47' ' ' LEU . 0.4 OUTLIER -67.87 -20.06 65.09 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 122.75 0.42 . . . . 0.0 110.783 179.189 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.484 ' HG ' ' CB ' ' A' ' 66' ' ' ALA . 0.0 OUTLIER -46.08 -35.23 4.73 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.652 0.595 . . . . 0.0 111.736 177.489 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.8 79.34 0.32 Allowed Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.485 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.414 ' CB ' HD11 ' A' ' 72' ' ' LEU . . . -67.53 -28.34 67.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.556 0.693 . . . . 0.0 109.251 174.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -133.96 -107.55 0.99 Allowed Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 110.361 -1.096 . . . . 0.0 110.361 172.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.1 mt -117.68 47.13 1.6 Allowed 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 174.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.408 HD11 ' OE2' ' A' ' 100' ' ' GLU . 2.2 mt -78.0 176.17 9.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.877 -174.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.579 ' CB ' ' HA ' ' A' ' 104' ' ' ASN . 3.0 m120 -138.83 -177.43 4.87 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.737 -175.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -112.41 -135.86 6.59 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.671 -0.775 . . . . 0.0 112.089 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.657 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -64.88 150.23 48.11 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.855 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.458 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -55.06 89.07 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.094 0.557 . . . . 0.0 112.099 -179.78 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.92 2.29 61.14 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 121.079 -0.582 . . . . 0.0 112.443 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.657 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 32.5 t-20 -122.35 98.22 5.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.944 0.402 . . . . 0.0 110.345 -179.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.16 72.7 9.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.237 0.542 . . . . 0.0 111.134 178.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.72 -48.17 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 -179.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -81.23 113.47 19.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 174.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.484 ' CB ' ' HG ' ' A' ' 51' ' ' LEU . . . -105.78 156.05 18.69 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.835 0.35 . . . . 0.0 111.011 -176.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.4 m -134.42 141.73 46.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.041 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.636 ' HB2' HD21 ' A' ' 50' ' ' LEU . . . -108.06 126.01 52.24 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.935 0.398 . . . . 0.0 110.454 176.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.658 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -80.77 166.42 21.0 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.694 175.758 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -50.72 -38.42 47.18 Favored 'General case' 0 C--N 1.329 -0.297 0 O-C-N 123.433 0.458 . . . . 0.0 111.813 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.3 -37.31 80.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.592 179.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.781 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -82.77 -23.24 34.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.71 -178.292 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.505 HG21 ' HG ' ' A' ' 12' ' ' LEU . 2.4 mt -63.88 -40.26 88.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 173.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -83.74 -4.34 58.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.118 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.781 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -81.7 -53.46 6.2 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 120.972 0.415 . . . . 0.0 110.58 -179.245 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.557 HD22 ' HB2' ' A' ' 50' ' ' LEU . 6.7 mp -110.98 -21.92 11.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.015 -176.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.41 46.09 6.64 Favored Glycine 0 CA--C 1.511 -0.186 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.275 -176.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.727 HD13 HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -76.79 147.18 37.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -174.036 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.84 14.9 5.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.328 174.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.1 -25.65 43.01 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.023 0.44 . . . . 0.0 111.09 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.496 HD23 ' HB2' ' A' ' 36' ' ' ASN . 8.1 mt -109.68 4.13 21.66 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.704 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -116.71 138.24 47.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.353 0.597 . . . . 0.0 110.819 -176.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.625 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 6.8 t0 -119.62 144.12 47.3 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 175.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -103.94 112.15 25.0 Favored 'General case' 0 C--N 1.316 -0.854 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.067 -174.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.0 p -107.46 -169.36 1.52 Allowed 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.963 174.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.8 pm0 -61.62 -24.44 66.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.604 178.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.35 -34.41 31.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.727 0.299 . . . . 0.0 111.092 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 143.48 -160.03 27.6 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.115 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_exo -71.92 97.55 0.83 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.207 2.604 . . . . 0.0 111.463 175.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.559 HG12 ' HB2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -113.01 -174.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.899 -175.722 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.456 ' SG ' HG12 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -67.69 127.66 33.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.084 0.469 . . . . 0.0 110.832 -177.793 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.625 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 6.5 tptp -73.53 -36.73 65.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.622 -178.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -144.37 -78.53 0.2 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -170.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.844 HG23 ' HB3' ' A' ' 109' ' ' ASP . 4.6 mt -110.92 136.18 47.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.404 -170.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.456 HG12 ' SG ' ' A' ' 91' ' ' CYS . 13.2 m -101.76 139.65 22.36 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 120.738 0.304 . . . . 0.0 110.853 177.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -155.24 166.92 32.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.134 0.492 . . . . 0.0 111.81 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.497 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.8 m -113.2 117.71 32.65 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 173.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.693 ' O ' ' HA ' ' A' ' 31' ' ' SER . 39.8 t -123.6 124.46 26.21 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.504 -175.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -84.26 127.9 4.06 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.815 2.343 . . . . 0.0 113.028 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.408 ' OE2' HD11 ' A' ' 56' ' ' LEU . 0.7 OUTLIER -73.33 105.37 4.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.042 0.448 . . . . 0.0 110.519 175.074 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 169.54 -80.44 0.1 OUTLIER Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 176.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.51 161.32 32.74 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 122.728 0.411 . . . . 0.0 109.892 176.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 23.7 m 79.76 150.66 0.11 Allowed 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.779 0.674 . . . . 0.0 110.733 -179.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.579 ' HA ' ' CB ' ' A' ' 57' ' ' ASN . 0.3 OUTLIER -71.28 173.9 7.15 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -168.679 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.575 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.15 142.83 44.13 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.496 -177.624 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -99.16 127.91 51.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 121.061 0.458 . . . . 0.0 110.031 -177.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -94.48 136.01 35.27 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.818 177.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.71 -0.99 9.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.275 0.559 . . . . 0.0 111.271 -178.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . 0.844 ' HB3' HG23 ' A' ' 94' ' ' ILE . 17.7 t0 . . . . . 0 C--N 1.318 -0.786 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.283 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.525 ' C ' ' H ' ' A' ' 14' ' ' THR . 7.9 mp . . . . . 0 N--CA 1.457 -0.108 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 70.68 -24.98 0.16 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.808 0.843 . . . . 0.0 111.393 -178.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.525 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -170.57 -42.57 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.508 ' HG ' ' N ' ' A' ' 12' ' ' LEU . 25.3 m 64.69 -74.45 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.416 -177.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.519 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . 52.99 -91.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.052 0.541 . . . . 0.0 111.307 -177.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.836 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . . . -63.15 -32.18 73.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.804 0.335 . . . . 0.0 110.526 177.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.523 ' HE2' ' SG ' ' A' ' 34' ' ' CYS . 28.5 t80 -68.71 -32.66 72.61 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.158 0.504 . . . . 0.0 110.05 176.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.34 -37.04 80.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.587 177.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.836 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 23.1 mttt -64.9 -36.96 86.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.38 0.609 . . . . 0.0 109.403 174.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -59.99 -40.87 90.63 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.309 174.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.21 -16.64 61.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.467 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.56 -40.44 11.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.658 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -75.83 -27.88 61.91 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.757 -177.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -114.33 146.23 40.78 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.586 0.231 . . . . 0.0 110.393 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.55 92.93 9.07 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 121.398 0.618 . . . . 0.0 111.208 -178.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.537 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -160.3 131.23 5.64 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 170.469 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -111.36 -175.15 2.63 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.517 -174.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.7 t -58.34 117.07 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.174 0.511 . . . . 0.0 109.849 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.538 ' O ' ' HA ' ' A' ' 99' ' ' PRO . . . 113.82 -23.68 12.87 Favored Glycine 0 N--CA 1.441 -1.001 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 -174.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.96 4.4 5.35 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.81 0.338 . . . . 0.0 111.2 178.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.448 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 5.3 tt -96.79 129.52 46.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.887 0.375 . . . . 0.0 110.807 -177.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.75 172.81 15.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.223 0.535 . . . . 0.0 111.929 -176.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.523 ' SG ' ' HE2' ' A' ' 18' ' ' PHE . 55.9 m -124.54 142.09 51.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.741 170.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -117.2 145.02 44.15 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.725 ' HB2' ' HB3' ' A' ' 81' ' ' LEU . 13.2 t-20 -131.6 159.74 37.37 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.942 0.401 . . . . 0.0 111.031 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -54.5 142.06 52.33 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.612 175.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.555 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 11.5 Cg_endo -55.39 -38.54 93.8 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 123.107 2.538 . . . . 0.0 112.795 -175.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.37 -16.69 64.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.963 0.411 . . . . 0.0 111.937 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -102.81 -42.68 5.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.526 179.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.66 -25.81 65.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.054 0.454 . . . . 0.0 110.841 178.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.555 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -104.84 14.29 29.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.4 179.499 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -62.32 -26.01 68.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.013 -175.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 1.026 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 14.6 t70 -122.03 150.85 41.51 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.588 0.232 . . . . 0.0 110.394 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.98 -35.03 79.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.216 -179.037 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.32 -15.99 26.64 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.464 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 1.026 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 5.0 tp -60.98 -40.94 95.35 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.085 -178.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -29.84 69.91 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.12 -177.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -84.59 -29.84 28.66 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.726 -0.749 . . . . 0.0 111.754 177.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.481 ' HA ' HD12 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -68.53 -20.81 64.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.919 0.39 . . . . 0.0 110.972 179.275 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.617 HD12 ' HB2' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -56.57 -30.99 63.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.236 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.608 ' HA3' ' HB2' ' A' ' 56' ' ' LEU . . . -137.24 100.07 0.31 Allowed Glycine 0 N--CA 1.441 -1.031 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.033 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.492 ' H ' HD21 ' A' ' 72' ' ' LEU . . . -75.1 55.14 0.72 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.107 0.479 . . . . 0.0 110.481 177.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 164.61 -118.08 0.79 Allowed Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.556 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.5 mp -120.02 52.89 1.1 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.933 0.397 . . . . 0.0 110.199 -177.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.608 ' HB2' ' HA3' ' A' ' 52' ' ' GLY . 0.3 OUTLIER -88.36 166.9 13.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.269 0.557 . . . . 0.0 111.828 -175.816 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.436 ' HB3' ' O ' ' A' ' 103' ' ' THR . 45.7 t30 -132.83 -179.13 5.29 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.384 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -101.64 -153.56 25.74 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.502 -0.856 . . . . 0.0 112.684 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.875 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 9.5 tp -67.38 143.47 56.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.561 0.22 . . . . 0.0 110.842 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.1 m -59.34 94.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.524 -179.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.62 -13.86 63.67 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.6 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.875 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 6.7 t-20 -99.72 92.22 5.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.021 0.439 . . . . 0.0 110.934 -177.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -76.14 72.22 2.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.049 176.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -179.46 -48.13 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.34 130.84 37.14 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.702 0.287 . . . . 0.0 110.397 176.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.02 164.58 14.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.204 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 0.2 OUTLIER -129.36 127.96 42.11 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 120.822 0.344 . . . . 0.0 110.169 -178.46 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 1.016 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -109.43 148.82 30.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.983 178.07 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' A' ' 32' ' ' ILE . 1.5 mppt? -92.46 168.25 11.4 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.614 -175.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.665 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -61.15 -32.62 72.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.197 -179.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.11 -48.6 77.84 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 176.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.514 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -57.78 -40.45 79.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.786 177.172 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.934 ' HA ' ' HB2' ' A' ' 78' ' ' LEU . 11.4 mt -60.73 -47.82 91.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.63 179.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.95 -30.64 70.83 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.1 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.437 ' C ' ' HG ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -62.58 -53.82 48.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.538 -171.231 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.437 ' HG ' ' C ' ' A' ' 75' ' ' GLN . 0.5 OUTLIER -138.67 25.53 2.59 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -171.247 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.508 ' O ' ' HG ' ' A' ' 79' ' ' LEU . . . 67.27 51.24 39.34 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 119.774 -1.203 . . . . 0.0 111.5 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.934 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 0.1 OUTLIER -73.53 72.57 1.4 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -174.227 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.798 ' HA ' ' HB ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -87.85 20.93 2.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.84 0.352 . . . . 0.0 110.905 178.092 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.432 ' HB2' ' HG ' ' A' ' 47' ' ' LEU . . . -65.1 -27.56 68.84 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.265 0.555 . . . . 0.0 110.558 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 1.016 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -132.52 13.09 4.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.123 179.502 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.798 ' HB ' ' HA ' ' A' ' 79' ' ' LEU . 53.8 t -115.36 137.3 49.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.615 -173.175 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -118.99 148.95 42.43 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 175.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 30.7 t-80 -109.87 115.49 29.91 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.089 -0.645 . . . . 0.0 111.65 -176.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.494 ' HB ' ' OE2' ' A' ' 87' ' ' GLU . 6.4 p -108.29 -173.92 2.39 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.466 174.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.47 -27.19 65.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.058 0.456 . . . . 0.0 110.051 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 16' ' ' ALA . 1.9 mp0 -68.33 -24.39 64.82 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.015 176.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 129.47 -158.54 22.17 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.418 178.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -73.79 120.21 6.29 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 123.188 2.592 . . . . 0.0 111.53 176.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.481 HG12 ' HB2' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -137.56 166.86 23.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.282 -175.878 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 9.0 m -67.09 139.02 57.54 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.217 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.9 tttp -75.93 -49.85 16.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.643 -175.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -129.9 -86.0 0.53 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -170.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 5.6 mt -85.52 132.73 31.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.036 -168.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -94.5 123.79 46.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.386 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.428 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . . . -153.33 151.73 30.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.527 -178.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.537 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 3.7 m -105.45 123.59 48.14 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.281 0.562 . . . . 0.0 109.699 178.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 26.6 t -130.31 128.57 22.71 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.983 -172.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.538 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 10.5 Cg_exo -70.91 141.41 40.51 Favored 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.786 2.324 . . . . 0.0 112.275 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -88.2 103.99 16.29 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 171.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.437 ' H ' HD11 ' A' ' 56' ' ' LEU . . . 165.09 -78.65 0.13 Allowed Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.41 HG22 ' H ' ' A' ' 103' ' ' THR . 0.3 OUTLIER -155.33 -174.81 5.13 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.54 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.436 ' O ' ' HB3' ' A' ' 57' ' ' ASN . 23.8 p 62.99 178.22 0.15 Allowed 'General case' 0 C--O 1.235 0.302 0 O-C-N 124.177 0.923 . . . . 0.0 112.449 178.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -93.02 173.96 7.47 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.721 -168.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.442 ' O ' HD12 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -112.72 143.01 44.67 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.446 -176.308 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -87.46 141.82 13.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.917 0.389 . . . . 0.0 110.46 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.682 ' HB2' HD11 ' A' ' 59' ' ' LEU . . . -105.18 124.34 49.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.97 0.414 . . . . 0.0 110.902 -178.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -101.39 18.71 3.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.504 0.669 . . . . 0.0 109.828 178.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 48.0 t0 . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.208 178.461 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.8 mp . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.403 ' O ' ' HB ' ' A' ' 14' ' ' THR . . . 54.04 67.09 1.06 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.607 -176.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.403 ' HB ' ' O ' ' A' ' 13' ' ' ALA . 37.4 m 79.28 -37.74 0.19 Allowed 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.245 -178.564 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.618 ' HB3' ' HB3' ' A' ' 18' ' ' PHE . 0.9 OUTLIER 54.41 53.11 11.29 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.855 0.36 . . . . 0.0 111.689 174.748 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.409 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . -58.16 -58.08 10.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.209 -177.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.634 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . . . -73.84 -16.96 61.12 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.249 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.618 ' HB3' ' HB3' ' A' ' 15' ' ' SER . 80.3 t80 -79.51 -35.75 39.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.863 0.364 . . . . 0.0 110.474 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.88 -30.43 71.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.862 0.363 . . . . 0.0 110.796 176.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.634 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 46.4 mttt -69.29 -20.47 63.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.399 0.618 . . . . 0.0 109.711 176.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.92 -46.12 10.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.401 177.521 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.79 -18.43 64.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.892 -171.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.1 -21.0 60.83 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.669 -177.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -101.36 3.5 54.36 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.39 -0.91 . . . . 0.0 112.75 -178.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.438 HG22 ' HB ' ' A' ' 108' ' ' VAL . 0.0 OUTLIER -121.99 134.25 54.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.933 0.366 . . . . 0.0 111.815 -175.381 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.48 96.97 4.84 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.178 174.597 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.588 ' SG ' ' HA ' ' A' ' 32' ' ' ILE . 0.5 OUTLIER -150.67 172.61 15.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.507 -179.289 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -123.85 159.39 29.71 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.739 -0.21 . . . . 0.0 110.589 -173.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 p -65.72 120.05 11.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.451 0.643 . . . . 0.0 110.144 178.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.84 -38.89 2.92 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.453 -175.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.8 OUTLIER -90.98 -1.62 57.8 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.032 0.444 . . . . 0.0 110.925 178.743 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.588 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 2.0 tt -80.25 134.47 27.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.644 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . . . -144.14 173.03 12.09 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.877 0.846 . . . . 0.0 113.115 -167.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 28.4 t -122.4 133.49 54.63 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.295 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.3 t -117.47 157.58 26.0 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.464 ' HB2' ' CD2' ' A' ' 81' ' ' LEU . 8.7 t-20 -149.07 159.33 44.33 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.743 -175.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.402 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.3 OUTLIER -53.82 135.62 55.98 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.641 174.676 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.454 ' HG3' ' OG ' ' A' ' 65' ' ' SER . 74.5 Cg_exo -47.29 -46.76 18.94 Favored 'Trans proline' 0 C--O 1.22 -0.388 0 C-N-CA 123.576 2.851 . . . . 0.0 113.834 -172.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.586 ' HA ' ' ND2' ' A' ' 42' ' ' ASN . . . -60.93 -9.41 4.17 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -173.628 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.593 ' O ' ' HB2' ' A' ' 43' ' ' ASN . 4.6 tt0 -112.49 -41.36 3.88 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.5 m -59.28 -42.89 92.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.957 0.884 . . . . 0.0 110.584 171.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.586 ' ND2' ' HA ' ' A' ' 39' ' ' ALA . 0.0 OUTLIER -87.8 11.06 16.45 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.885 -175.243 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.593 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 1.8 t-20 -51.55 -34.8 38.13 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.968 -174.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 1.053 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 28.5 t70 -116.13 147.38 41.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.872 0.368 . . . . 0.0 110.997 178.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -40.52 97.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.134 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.28 -29.05 26.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.752 0.311 . . . . 0.0 110.319 -178.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 1.053 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -55.12 -32.94 62.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.574 173.346 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.508 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -65.84 -9.8 32.23 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.443 179.547 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -116.52 -8.89 11.99 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 172.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.595 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 1.2 tp -84.06 -19.99 33.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.976 0.417 . . . . 0.0 110.964 -176.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.508 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.1 OUTLIER -67.24 -21.61 65.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.415 -179.091 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.13 91.77 0.28 Allowed Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.52 ' H ' HD21 ' A' ' 72' ' ' LEU . . . -58.49 -30.75 67.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.767 0.318 . . . . 0.0 111.757 -174.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -96.14 29.73 9.65 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.694 -179.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.0 mt 61.59 54.95 2.88 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.4 0.619 . . . . 0.0 109.8 -175.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.608 HD22 ' NZ ' ' A' ' 69' ' ' LYS . 0.5 OUTLIER -80.89 -161.97 0.44 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.229 -176.498 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.436 ' H ' ' CG ' ' A' ' 56' ' ' LEU . 7.9 t-20 -133.03 -177.17 4.39 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.234 -174.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -95.52 -144.2 16.24 Favored Glycine 0 C--N 1.314 -0.645 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -176.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.801 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -66.59 155.03 38.94 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 175.074 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.453 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 1.6 t -61.33 100.49 0.13 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.013 0.435 . . . . 0.0 111.322 -178.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.01 -0.4 69.25 Favored Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.142 -179.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.801 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 24.1 t-20 -128.95 97.04 4.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.109 0.481 . . . . 0.0 110.257 -176.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.06 71.09 10.26 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.334 0.588 . . . . 0.0 111.072 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -167.23 -50.92 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.134 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.454 ' OG ' ' HG3' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -89.75 79.87 6.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.139 0.495 . . . . 0.0 109.862 174.312 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.463 ' HB3' HD22 ' A' ' 51' ' ' LEU . . . -86.7 164.19 16.9 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.199 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.789 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -131.86 153.03 50.62 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.578 -179.028 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -116.67 138.74 51.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.244 -178.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.793 ' HE3' HD23 ' A' ' 72' ' ' LEU . 0.0 OUTLIER -88.28 165.45 15.01 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.962 -177.083 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.436 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -62.33 -25.31 67.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.108 0.48 . . . . 0.0 110.96 -179.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -32.39 70.24 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.441 0.639 . . . . 0.0 109.577 177.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.793 HD23 ' HE3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -73.9 -30.82 62.8 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.574 178.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.436 HD12 ' HA ' ' A' ' 70' ' ' ALA . 3.5 mt -67.87 -35.68 73.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.597 176.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -74.8 -31.43 61.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.933 177.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.08 -52.83 6.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.824 -176.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.535 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 2.8 mm? -105.64 -45.81 4.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.443 -173.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.54 49.59 5.1 Favored Glycine 0 CA--C 1.518 0.279 0 C-N-CA 119.994 -1.098 . . . . 0.0 112.533 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.468 ' HB3' HD11 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -77.59 106.68 9.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.893 0.378 . . . . 0.0 110.978 -179.239 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.621 ' HA ' HG12 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -66.87 -18.29 65.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.938 -177.909 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.73 -21.65 64.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.809 0.337 . . . . 0.0 111.357 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.464 ' CD2' ' HB2' ' A' ' 36' ' ' ASN . 1.9 mt -123.45 28.6 6.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.291 0.567 . . . . 0.0 111.298 -176.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.621 HG12 ' HA ' ' A' ' 79' ' ' LEU . 2.0 p -142.44 145.41 23.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.313 176.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.604 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 9.8 t70 -122.88 171.09 9.47 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.05 177.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.31 80.29 1.79 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.143 0.497 . . . . 0.0 111.223 -174.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.541 HG23 ' H ' ' A' ' 87' ' ' GLU . 1.6 t -78.86 171.81 14.65 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 172.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -51.4 -38.98 56.23 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -176.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.541 ' H ' HG23 ' A' ' 85' ' ' THR . 17.1 mt-10 -88.91 48.35 1.62 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.0 0.429 . . . . 0.0 111.886 -176.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.44 -175.78 49.56 Favored Glycine 0 CA--C 1.522 0.482 0 CA-C-N 115.82 -0.627 . . . . 0.0 113.993 172.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -62.96 138.09 66.14 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.985 2.456 . . . . 0.0 111.547 175.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.453 HG11 ' HB3' ' A' ' 17' ' ' ALA . 0.3 OUTLIER -149.51 173.43 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.152 -172.815 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 14.1 t -67.64 143.3 56.07 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 174.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.604 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 2.8 tttp -78.24 -46.3 20.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.38 -176.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.514 ' HB3' HG13 ' A' ' 94' ' ' ILE . 4.5 m-20 -142.89 -82.14 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.029 0.442 . . . . 0.0 111.948 -172.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.514 HG13 ' HB3' ' A' ' 93' ' ' ASN . 2.1 mt -96.65 130.31 45.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.237 -170.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.3 p -83.42 138.06 19.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.668 0.27 . . . . 0.0 110.371 176.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.41 ' HA ' HG23 ' A' ' 108' ' ' VAL . . . -148.68 164.18 35.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.017 0.437 . . . . 0.0 111.926 -175.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.55 122.28 46.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.314 175.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.789 ' SG ' ' HB2' ' A' ' 67' ' ' CYS . 57.0 m -132.71 127.58 20.49 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.516 -173.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -86.89 178.11 3.8 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.118 1.879 . . . . 0.0 110.965 173.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.458 ' HA ' HD13 ' A' ' 56' ' ' LEU . 1.0 OUTLIER -123.94 157.52 34.12 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 168.99 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 102.26 -45.15 1.4 Allowed Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.865 -178.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.42 HG23 ' OG1' ' A' ' 103' ' ' THR . 10.5 t -177.92 174.97 1.36 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.824 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.6 OUTLIER 68.52 -175.11 0.2 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.594 176.672 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.824 ' H ' HG22 ' A' ' 103' ' ' THR . 0.3 OUTLIER -104.91 -178.9 3.79 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.079 -164.016 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 68.6 m -112.52 143.48 43.6 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.858 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 86.9 t -103.71 113.33 40.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.176 175.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.98 118.32 18.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 174.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.438 ' HB ' HG22 ' A' ' 25' ' ' THR . 0.1 OUTLIER -96.05 17.61 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.806 -170.575 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 43.0 t0 . . . . . 0 C--N 1.32 -0.682 0 CA-C-O 121.556 0.693 . . . . 0.0 110.191 174.267 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.598 ' N ' ' HG ' ' A' ' 15' ' ' SER . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.263 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 74.76 -44.47 0.55 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.212 -172.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.437 ' O ' ' HB2' ' A' ' 15' ' ' SER . 0.5 OUTLIER -158.44 -40.16 0.06 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.79 -177.961 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.598 ' HG ' ' N ' ' A' ' 12' ' ' LEU . 2.7 m 69.75 -69.32 0.17 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.513 -177.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 47.26 -92.58 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.475 0.71 . . . . 0.0 112.154 178.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.521 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . . . -62.9 -30.53 71.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.191 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.63 ' HB2' HG12 ' A' ' 90' ' ' VAL . 15.3 t80 -67.12 -27.6 67.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 110.305 177.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.87 -20.85 60.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.539 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.521 ' HD3' ' HA ' ' A' ' 17' ' ' ALA . 5.0 mtpp -71.83 -26.84 62.54 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.34 -36.57 19.16 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 113.893 -1.503 . . . . 0.0 110.541 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.67 -14.0 61.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.055 -174.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -109.15 16.77 22.25 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.445 0.641 . . . . 0.0 110.442 175.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -115.86 -27.67 2.92 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.22 174.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.67 142.22 34.71 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -91.12 96.7 10.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.932 0.396 . . . . 0.0 110.741 178.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.444 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 81.6 m -148.92 -179.04 6.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -98.73 159.87 14.66 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.425 ' H ' HG22 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -64.12 -49.48 81.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 120.798 0.332 . . . . 0.0 111.581 -178.113 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.21 -27.67 57.46 Favored Glycine 0 CA--C 1.509 -0.3 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.803 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -100.77 46.17 0.95 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.717 0.294 . . . . 0.0 111.218 -175.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.3 tt -112.32 138.84 39.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 174.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.405 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -146.54 155.32 42.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.536 0.684 . . . . 0.0 112.626 -171.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.6 m -109.88 133.23 53.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.637 174.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.41 ' HA ' HD22 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -123.13 165.13 17.36 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.6 -178.387 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.421 ' HB3' ' OG1' ' A' ' 41' ' ' THR . 3.2 t30 -149.29 161.16 42.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.71 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -49.02 127.36 14.73 Favored Pre-proline 0 C--O 1.237 0.398 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.572 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.465 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 31.4 Cg_exo -47.93 -47.45 18.93 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 123.815 3.01 . . . . 0.0 113.925 -178.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.51 -20.58 56.49 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -173.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -102.91 -48.57 4.03 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.033 0.444 . . . . 0.0 109.839 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.448 HG21 HD21 ' A' ' 81' ' ' LEU . 88.1 m -59.31 -35.95 74.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.564 177.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.4 m-80 -103.88 14.69 30.29 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.316 -173.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -69.08 -21.64 64.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.217 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.928 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.0 t70 -103.66 152.76 21.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.495 179.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.91 -29.41 44.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.743 0.306 . . . . 0.0 111.441 -177.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.469 ' HG ' HD13 ' A' ' 50' ' ' LEU . 9.6 tp -90.03 -36.98 14.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.698 0.285 . . . . 0.0 110.493 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.928 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.4 OUTLIER -50.47 -38.69 45.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.67 178.058 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.424 ' HA ' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -63.97 -28.18 69.64 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.573 -176.349 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -95.31 -25.1 14.66 Favored Glycine 0 C--N 1.33 0.207 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.626 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.557 ' HB3' HD21 ' A' ' 78' ' ' LEU . 1.2 tp -63.64 -32.89 74.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.969 0.414 . . . . 0.0 110.623 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 47' ' ' LEU . 7.6 mt -60.53 -39.89 89.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.631 177.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.694 ' HA2' ' HG ' ' A' ' 56' ' ' LEU . . . -87.08 67.6 3.34 Favored Glycine 0 N--CA 1.443 -0.865 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.654 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -68.5 -23.85 64.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.435 0.636 . . . . 0.0 110.437 -176.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -124.55 25.66 5.89 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.046 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 63.74 39.26 8.65 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.471 0.653 . . . . 0.0 109.86 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.694 ' HG ' ' HA2' ' A' ' 52' ' ' GLY . 0.7 OUTLIER -80.32 179.66 7.57 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.038 177.392 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.936 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 7.9 t-20 -118.75 -177.27 3.27 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.37 -175.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -97.93 -143.06 14.1 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.453 -176.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.553 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -65.54 148.89 50.97 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 178.957 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.569 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -57.24 90.28 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.64 -178.684 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.78 -10.34 70.54 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.86 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.553 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 57.9 t30 -117.55 105.93 12.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.284 0.564 . . . . 0.0 111.72 -174.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.44 131.5 42.65 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.359 178.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.48 -56.44 0.73 Allowed Glycine 0 CA--C 1.509 -0.325 0 C-N-CA 121.1 -0.571 . . . . 0.0 111.954 177.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.2 90.97 4.92 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.97 0.414 . . . . 0.0 110.42 178.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.02 160.74 16.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.079 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 64.7 m -126.55 130.84 51.34 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.061 0.457 . . . . 0.0 110.994 -178.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -105.49 125.83 51.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.578 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.452 ' NZ ' ' HA ' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -82.66 167.47 18.22 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.771 -178.555 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.46 ' HB2' HD22 ' A' ' 12' ' ' LEU . . . -60.55 -30.28 69.68 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.301 0.572 . . . . 0.0 109.997 175.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -23.12 63.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.511 176.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.823 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 1.3 tp -87.65 -24.03 24.05 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.501 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -60.29 -38.01 75.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -90.52 -5.11 56.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.408 0.623 . . . . 0.0 110.704 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.823 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -87.38 -54.16 4.44 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.138 -176.798 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.486 ' HA ' HD13 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -126.73 -9.91 6.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.509 -176.495 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 67.33 47.93 60.92 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.407 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.557 HD21 ' HB3' ' A' ' 50' ' ' LEU . 65.6 mt -71.19 129.91 40.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.653 0.263 . . . . 0.0 111.264 -178.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.63 4.16 19.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.093 177.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.49 -29.56 62.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.098 -174.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.448 HD21 HG21 ' A' ' 41' ' ' THR . 0.0 OUTLIER -128.89 4.92 5.4 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.973 0.416 . . . . 0.0 111.355 -174.666 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 6.2 t -111.11 137.66 42.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.885 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.904 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 6.9 t0 -115.47 154.61 28.99 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.7 m80 -125.87 114.6 18.76 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.316 0.579 . . . . 0.0 110.179 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.07 -169.96 1.56 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.143 -177.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -72.63 -19.75 61.39 Favored 'General case' 0 C--N 1.323 -0.57 0 O-C-N 123.335 0.397 . . . . 0.0 111.0 -178.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -89.14 -14.05 37.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.01 177.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 128.85 -152.79 19.47 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.516 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -79.51 129.59 8.49 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 123.321 2.68 . . . . 0.0 111.91 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.63 HG12 ' HB2' ' A' ' 18' ' ' PHE . 3.1 m -149.55 -178.56 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.237 -175.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.92 133.7 43.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.237 177.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.904 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 8.1 tttp -74.98 -49.92 18.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.545 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -136.84 -74.91 0.42 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.149 -172.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.0 mt -98.93 138.63 22.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.602 -171.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.4 p -112.27 138.93 39.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.478 ' CB ' ' HA ' ' A' ' 107' ' ' ALA . . . -150.2 168.93 22.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.05 0.452 . . . . 0.0 111.867 -176.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.444 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -112.03 117.17 31.95 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 171.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.479 ' HA ' ' HB3' ' A' ' 105' ' ' CYS . 44.5 t -138.69 139.76 25.31 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.673 0.273 . . . . 0.0 111.735 -170.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -82.86 -178.42 3.88 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 123.35 2.7 . . . . 0.0 112.093 176.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.452 ' HA ' ' NZ ' ' A' ' 69' ' ' LYS . 3.2 tp10 -80.18 -30.63 38.82 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -177.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.594 ' HA2' ' HA ' ' A' ' 56' ' ' LEU . . . -178.82 64.56 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 119.532 -1.318 . . . . 0.0 113.202 -178.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -153.94 108.54 3.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.601 0.239 . . . . 0.0 110.471 175.084 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 54.61 -176.25 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.669 0.747 . . . . 0.0 112.52 -178.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.936 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -74.42 165.44 25.19 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.734 -178.009 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.479 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 2.5 m -111.03 143.16 42.16 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.002 -175.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.0 p -85.35 120.79 36.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.125 0.488 . . . . 0.0 111.254 -176.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.529 ' HB3' HD11 ' A' ' 59' ' ' LEU . . . -96.88 125.76 41.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.144 175.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -89.38 10.52 2.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.109 0.48 . . . . 0.0 110.945 -178.173 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.2 t0 . . . . . 0 C--N 1.322 -0.614 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.306 179.381 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.629 ' N ' ' HG ' ' A' ' 15' ' ' SER . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.139 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 70.88 -53.42 0.67 Allowed 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.59 0.756 . . . . 0.0 109.752 -167.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.61 -34.12 0.19 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.344 175.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.629 ' HG ' ' N ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER 62.53 32.34 16.57 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.398 -0.819 . . . . 0.0 112.096 175.467 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.1 -37.92 84.76 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.136 0.493 . . . . 0.0 110.073 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.37 -33.63 19.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.552 177.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.614 ' CD2' ' HG ' ' A' ' 12' ' ' LEU . 87.7 t80 -69.66 -44.35 70.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.453 -177.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.44 0.67 0.66 Allowed 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HG3' ' OE1' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -73.37 -5.89 42.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.623 0.725 . . . . 0.0 109.112 176.178 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.556 ' HB3' HD11 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -82.88 -8.82 59.54 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.377 176.97 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -109.11 3.76 22.29 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.757 175.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.47 ' OE1' ' HG3' ' A' ' 20' ' ' LYS . 41.6 mt-10 -115.68 -75.97 0.58 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.734 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -70.07 -42.52 67.62 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.893 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.472 ' OG1' ' HA ' ' A' ' 21' ' ' GLN . 0.2 OUTLIER -83.82 132.05 34.84 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.397 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.88 95.32 7.3 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.232 0.539 . . . . 0.0 110.681 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 60.7 m -144.56 -178.32 5.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.256 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -110.84 148.36 32.57 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.9 t -66.87 -47.43 82.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.912 0.387 . . . . 0.0 110.744 -177.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.73 18.51 5.81 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.322 177.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -152.42 38.0 0.54 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.556 HD11 ' HB3' ' A' ' 21' ' ' GLN . 0.2 OUTLIER -96.57 136.56 27.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.087 -178.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.477 ' HB2' ' HB3' ' A' ' 98' ' ' CYS . . . -149.53 -179.72 7.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.18 0.514 . . . . 0.0 112.204 -175.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.549 ' SG ' ' HE1' ' A' ' 18' ' ' PHE . 64.8 m -131.81 144.82 51.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.814 175.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.443 ' HA ' ' HG ' ' A' ' 81' ' ' LEU . 0.9 OUTLIER -134.72 165.08 26.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.645 0.26 . . . . 0.0 110.568 -176.105 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.461 ' CB ' HD12 ' A' ' 81' ' ' LEU . 33.7 t-20 -154.08 161.16 42.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.258 177.69 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.5 m -53.99 146.92 26.79 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.139 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.428 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 46.4 Cg_exo -56.58 -33.74 93.75 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 123.05 2.5 . . . . 0.0 113.004 -175.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.05 -14.87 63.32 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.61 -48.7 3.37 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.311 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.72 ' HA ' ' HB1' ' A' ' 80' ' ' ALA . 3.1 m -56.29 -36.28 68.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.468 178.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.8 m-80 -105.58 14.23 28.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.847 -174.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -62.53 -26.49 68.59 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.952 0.406 . . . . 0.0 111.178 -175.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.829 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 8.0 t70 -119.02 146.16 45.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.683 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -24.85 62.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.105 0.479 . . . . 0.0 111.122 -179.342 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.2 tp -90.83 -23.58 20.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.104 177.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.829 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.7 OUTLIER -60.01 -45.92 91.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.876 179.99 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.8 -32.87 74.64 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.931 -178.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -75.86 -22.3 74.78 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 121.011 -0.614 . . . . 0.0 111.778 176.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.574 ' HG ' ' HB3' ' A' ' 76' ' ' LEU . 0.7 OUTLIER -75.44 -26.17 58.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.038 0.447 . . . . 0.0 109.855 177.881 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.747 HD11 HD21 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -67.33 -40.33 85.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.716 179.139 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.66 72.19 1.72 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.336 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.37 -17.04 61.86 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.165 0.507 . . . . 0.0 110.312 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.24 47.46 0.8 Allowed Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.619 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.9 mt 55.39 51.79 12.38 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.181 0.515 . . . . 0.0 110.743 -177.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.726 HD21 ' H ' ' A' ' 101' ' ' GLY . 12.8 mt -88.84 172.27 9.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.887 -177.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.504 ' HB2' ' C ' ' A' ' 103' ' ' THR . 4.3 m-20 -114.59 -178.39 3.36 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.378 174.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -99.46 -131.88 7.49 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.346 -0.93 . . . . 0.0 111.025 178.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.827 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.3 OUTLIER -67.92 155.89 38.41 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 171.339 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.402 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -52.24 105.7 0.12 Allowed 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 120.84 0.352 . . . . 0.0 111.148 -178.128 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.14 33.26 85.27 Favored Glycine 0 C--N 1.335 0.506 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.414 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.827 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 25.1 t-20 -126.08 100.9 6.54 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.904 0.383 . . . . 0.0 110.399 -176.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.45 77.56 9.21 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.085 0.469 . . . . 0.0 111.105 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.07 -55.62 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.91 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.6 m -88.66 129.59 35.48 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 176.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.643 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . . . -131.82 153.96 49.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.592 0.234 . . . . 0.0 110.423 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.695 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 0.8 OUTLIER -118.09 135.55 54.13 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.272 0.558 . . . . 0.0 111.201 -174.343 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.406 ' CB ' HD23 ' A' ' 81' ' ' LEU . . . -105.71 146.52 29.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.294 177.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.517 ' HE3' ' HG2' ' A' ' 100' ' ' GLU . 1.6 mppt? -102.36 168.33 9.39 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.36 -36.14 77.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.019 0.437 . . . . 0.0 110.809 178.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.612 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -62.85 -27.7 69.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.517 176.861 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.572 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 4.0 mp -82.21 -25.55 34.1 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.709 -178.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.23 -36.68 77.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.045 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -100.05 4.08 44.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.767 177.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.612 ' HB2' ' O ' ' A' ' 71' ' ' SER . 1.0 OUTLIER -94.92 -53.89 3.67 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.114 -178.783 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.574 ' HB3' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -123.89 -30.98 3.46 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.964 -175.522 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.94 50.76 3.19 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.02 -1.086 . . . . 0.0 112.0 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.438 ' CD1' ' HB3' ' A' ' 50' ' ' LEU . 3.7 mm? -57.44 113.08 1.62 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.754 0.312 . . . . 0.0 110.976 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -97.27 6.32 48.57 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.189 -177.896 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.72 ' HB1' ' HA ' ' A' ' 41' ' ' THR . . . -89.37 -40.84 12.48 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -175.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.747 HD21 HD11 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -99.21 -4.68 31.47 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.728 -171.749 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 2.8 t -108.86 137.94 38.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.875 0.369 . . . . 0.0 111.023 -174.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.716 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 27.7 t0 -120.29 174.42 6.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.108 179.204 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 27.1 p80 -60.11 140.51 56.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.115 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.483 ' HB ' HG22 ' A' ' 90' ' ' VAL . 5.3 t -143.14 160.68 39.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.852 -177.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -115.29 16.18 16.85 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.436 0.636 . . . . 0.0 109.71 176.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.44 ' HB3' ' H ' ' A' ' 88' ' ' GLY . 6.4 tm-20 -139.8 -93.48 0.17 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.42 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.534 ' O ' HG13 ' A' ' 90' ' ' VAL . . . -122.62 160.35 17.1 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 175.127 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.511 ' O ' HD12 ' A' ' 12' ' ' LEU . 51.3 Cg_exo -52.21 128.84 28.8 Favored 'Trans proline' 0 N--CA 1.474 0.326 0 C-N-CA 122.791 2.328 . . . . 0.0 112.259 -176.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 88' ' ' GLY . 29.0 m -125.16 159.72 31.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.946 -175.234 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.4 m -66.84 142.52 57.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.066 0.46 . . . . 0.0 111.227 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.716 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 2.0 tttp -75.43 -37.92 60.1 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.692 -176.515 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 12.1 m-20 -146.63 -72.13 0.23 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.27 -0.423 . . . . 0.0 112.015 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.42 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 74.7 mt -86.87 126.68 40.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.566 -171.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 27.4 m -92.93 128.91 44.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.404 174.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.509 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . . . -154.84 156.68 36.64 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.796 0.331 . . . . 0.0 111.097 -176.206 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.58 131.27 53.18 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 174.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.51 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 28.3 t -143.73 134.86 12.54 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.154 -172.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -85.26 155.8 10.97 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 122.488 2.126 . . . . 0.0 111.838 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.517 ' HG2' ' HE3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -100.55 127.63 46.86 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 176.221 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.726 ' H ' HD21 ' A' ' 56' ' ' LEU . . . 100.41 -7.7 58.3 Favored Glycine 0 N--CA 1.44 -1.077 0 C-N-CA 120.745 -0.74 . . . . 0.0 113.379 176.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.76 121.15 10.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -172.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.504 ' C ' ' HB2' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 41.52 -135.11 0.28 Allowed 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.876 1.435 . . . . 0.0 114.876 168.708 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.469 ' H ' ' HB ' ' A' ' 103' ' ' THR . 0.3 OUTLIER -111.83 179.57 3.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.558 0.694 . . . . 0.0 112.599 -164.237 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.695 ' SG ' ' HB2' ' A' ' 67' ' ' CYS . 0.0 OUTLIER -118.47 154.98 31.6 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.735 -1.12 . . . . 0.0 111.052 -176.727 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.3 m -103.76 137.92 30.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.348 178.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -104.57 142.04 35.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.087 -176.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -122.62 20.6 4.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.294 0.568 . . . . 0.0 111.21 -178.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 . . . . . 0 C--N 1.322 -0.613 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.86 -178.406 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.61 ' HG ' ' OG ' ' A' ' 15' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 121.017 0.436 . . . . 0.0 110.097 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.436 ' O ' ' HB ' ' A' ' 14' ' ' THR . . . 60.69 60.4 1.93 Allowed 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.551 177.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.436 ' HB ' ' O ' ' A' ' 13' ' ' ALA . 87.5 m 76.68 -48.9 0.56 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.412 -178.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.658 ' HB3' ' HB3' ' A' ' 18' ' ' PHE . 20.2 m 57.29 41.25 26.97 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.141 0.276 . . . . 0.0 111.108 179.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.574 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . -55.38 -50.14 70.49 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.771 0.319 . . . . 0.0 111.348 -173.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -93.61 -19.09 21.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.956 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.658 ' HB3' ' HB3' ' A' ' 15' ' ' SER . 19.9 t80 -70.13 -24.57 63.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.963 0.411 . . . . 0.0 110.089 177.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.96 -37.21 86.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.706 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.19 -33.4 71.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.519 0.676 . . . . 0.0 109.323 177.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.85 -39.05 80.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.475 176.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.43 -16.06 63.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.748 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -101.96 0.89 36.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.816 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.9 -32.43 63.65 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.913 -0.66 . . . . 0.0 111.94 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.04 158.89 44.07 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 177.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.52 95.3 1.78 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.214 0.531 . . . . 0.0 111.592 -176.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.1 m -148.24 150.36 33.55 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.123 176.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.44 -164.93 2.14 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 p -57.17 127.55 16.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.142 0.496 . . . . 0.0 110.5 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.537 ' O ' ' HA ' ' A' ' 99' ' ' PRO . . . 106.37 -30.46 9.53 Favored Glycine 0 N--CA 1.445 -0.743 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.177 -178.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.6 p -124.02 -11.17 7.61 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.6 tt -83.06 125.8 40.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.408 0.623 . . . . 0.0 110.751 -177.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.49 178.27 9.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.063 -179.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 12.2 m -125.8 137.84 53.8 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.221 173.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.493 ' C ' HD21 ' A' ' 81' ' ' LEU . 1.2 m -113.13 156.01 23.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.749 0.309 . . . . 0.0 110.824 -176.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.567 ' HB2' ' CD2' ' A' ' 81' ' ' LEU . 16.6 t-20 -141.52 159.39 42.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.959 0.409 . . . . 0.0 111.276 -177.021 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.78 138.52 95.37 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.998 175.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.557 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 11.9 Cg_endo -55.01 -34.61 87.61 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.006 2.471 . . . . 0.0 112.798 -175.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.8 -8.3 42.08 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.048 0.451 . . . . 0.0 111.61 -178.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -108.25 -50.28 3.06 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.849 HG22 HD21 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -61.57 -35.06 76.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.99 -1.004 . . . . 0.0 111.668 -179.658 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.557 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.7 m-80 -104.11 15.49 28.33 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.644 -172.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -58.91 -28.37 66.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.203 -177.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.935 ' HB3' ' HG ' ' A' ' 47' ' ' LEU . 15.0 t70 -122.52 146.16 47.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.191 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -22.33 62.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.815 -178.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.9 tp -90.38 -27.63 19.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.675 0.274 . . . . 0.0 110.299 178.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.935 ' HG ' ' HB3' ' A' ' 44' ' ' ASP . 19.2 mt -58.77 -40.6 84.4 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.643 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.87 -24.53 67.56 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.089 -178.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.55 -18.03 46.79 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.073 -0.584 . . . . 0.0 111.889 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.93 -18.14 48.13 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.166 0.508 . . . . 0.0 110.024 177.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.849 HD21 HG22 ' A' ' 41' ' ' THR . 0.1 OUTLIER -67.45 -43.19 81.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.696 176.847 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -104.16 86.85 0.53 Allowed Glycine 0 N--CA 1.442 -0.95 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.881 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.4 64.62 5.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.402 0.62 . . . . 0.0 109.559 174.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.36 -121.37 2.97 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 -175.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.659 ' HB3' HG23 ' A' ' 102' ' ' THR . 2.1 mt -111.92 47.59 1.04 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.069 0.462 . . . . 0.0 111.156 178.639 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.66 143.52 29.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.229 178.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -117.46 -177.56 3.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.711 -176.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -106.35 -142.42 10.84 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.599 -173.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.444 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -66.86 154.28 41.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.887 0.375 . . . . 0.0 111.14 -179.816 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.0 p -67.93 89.4 0.28 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.905 177.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.87 -45.07 1.47 Allowed Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 116.053 -0.522 . . . . 0.0 112.521 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.48 113.36 12.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.992 0.425 . . . . 0.0 111.064 -177.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.51 114.72 21.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.752 178.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 137.74 -53.08 0.73 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.754 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.53 136.58 44.08 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 176.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.513 ' HB3' HG21 ' A' ' 41' ' ' THR . . . -129.78 167.37 18.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.554 -178.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.463 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -125.43 130.14 51.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.188 178.5 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.407 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -105.34 136.23 45.27 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.795 0.331 . . . . 0.0 110.117 -178.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.457 ' HE2' ' HG3' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -100.99 155.73 17.81 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.094 -177.825 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.414 ' CB ' HD22 ' A' ' 12' ' ' LEU . . . -65.97 -23.61 66.63 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.122 -178.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -27.15 56.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.91 0.862 . . . . 0.0 109.17 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.6 -25.1 21.49 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.303 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.472 ' HA ' ' HB2' ' A' ' 78' ' ' LEU . 0.8 OUTLIER -63.2 -39.83 86.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.959 179.062 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -78.73 -2.99 42.01 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.17 0.51 . . . . 0.0 110.987 178.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.415 ' HB3' HD12 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -81.37 -39.16 25.45 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.724 -173.883 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.415 HD12 ' HB3' ' A' ' 75' ' ' GLN . 1.2 mp -143.84 14.81 1.73 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.707 -176.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.61 44.18 96.88 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.329 -0.939 . . . . 0.0 111.094 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.472 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 3.8 mp -53.47 126.41 21.36 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.183 -0.508 . . . . 0.0 111.143 -176.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.36 -1.8 11.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.772 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.702 ' HB2' HD22 ' A' ' 47' ' ' LEU . . . -79.78 -4.48 52.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.983 -174.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.567 ' CD2' ' HB2' ' A' ' 36' ' ' ASN . 0.3 OUTLIER -155.05 36.37 0.39 Allowed 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -172.955 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.15 137.96 37.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 120.999 0.428 . . . . 0.0 110.327 175.079 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.947 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 2.3 t0 -109.29 158.5 17.8 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 173.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -124.43 114.96 20.18 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 119.653 -0.819 . . . . 0.0 112.725 -170.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -107.95 -169.95 1.6 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.732 171.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -81.68 -7.62 59.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.72 0.295 . . . . 0.0 111.581 -175.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.574 ' HB3' ' HB3' ' A' ' 16' ' ' ALA . 0.3 OUTLIER -104.43 12.95 32.76 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 120.862 0.363 . . . . 0.0 110.782 -178.154 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 115.42 -166.43 12.22 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.602 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -80.07 136.05 11.41 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 123.369 2.713 . . . . 0.0 111.323 176.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -140.29 -170.76 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.289 -175.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -66.49 132.0 47.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.09 0.472 . . . . 0.0 110.802 -177.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.947 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 6.3 tptp -74.7 -35.29 62.74 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.408 -175.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -155.34 -74.34 0.11 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.603 -175.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.6 mp -98.89 138.11 24.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.39 -172.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 25.7 t -97.28 118.47 43.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.945 178.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -144.03 160.67 40.47 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.745 0.307 . . . . 0.0 110.99 -176.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.13 124.8 50.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.497 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 45.9 t -136.0 117.85 11.89 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.971 -172.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.537 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 89.2 Cg_endo -76.14 138.27 20.18 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 122.863 2.375 . . . . 0.0 112.058 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.457 ' HG3' ' HE2' ' A' ' 69' ' ' LYS . 3.8 tt0 -85.91 139.33 31.33 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.54 176.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 128.62 -63.41 0.62 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.976 -0.63 . . . . 0.0 111.55 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.659 HG23 ' HB3' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -167.28 176.18 6.88 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 122.635 0.374 . . . . 0.0 110.196 178.378 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.537 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.7 OUTLIER 73.84 166.11 0.29 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.672 0.749 . . . . 0.0 112.158 177.407 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.537 ' H ' HG22 ' A' ' 103' ' ' THR . 21.5 m-20 -79.01 173.18 12.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.644 -1.162 . . . . 0.0 112.224 -174.129 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.497 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -113.27 142.94 45.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.744 175.381 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -102.91 142.01 17.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.066 0.46 . . . . 0.0 111.215 -175.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -106.86 122.84 47.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.339 177.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.33 17.59 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.931 -177.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.834 -178.032 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.486 ' N ' ' HG ' ' A' ' 15' ' ' SER . 3.8 mp . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 120.584 0.231 . . . . 0.0 110.39 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 69.48 -13.63 0.37 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.716 0.806 . . . . 0.0 111.888 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.47 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -164.26 -55.3 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 177.705 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.508 ' HB2' ' H ' ' A' ' 16' ' ' ALA . 0.3 OUTLIER 56.7 -96.69 0.07 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.991 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.508 ' H ' ' HB2' ' A' ' 15' ' ' SER . . . 53.46 -91.97 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.66 0.6 . . . . 0.0 111.507 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.599 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . . . -53.85 -38.78 65.02 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.059 0.457 . . . . 0.0 110.871 174.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.512 ' HB2' HG12 ' A' ' 90' ' ' VAL . 65.5 t80 -73.5 -35.18 65.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.539 177.43 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 23' ' ' GLU . . . -65.16 -21.06 66.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.577 -174.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.599 ' HE3' ' HA ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -52.4 -24.43 7.73 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.943 0.401 . . . . 0.0 111.115 177.033 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.93 -31.49 72.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.918 179.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.46 -17.25 27.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.21 -176.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.506 ' HG3' ' HA ' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -97.26 -45.31 6.55 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.871 -179.26 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.57 -37.07 21.42 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.377 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.94 153.43 28.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.871 0.367 . . . . 0.0 111.025 -177.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.66 98.35 11.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.999 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.2 m -135.5 170.8 15.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.746 176.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.418 ' H ' ' HB2' ' A' ' 31' ' ' SER . 2.2 t-20 -111.16 164.83 12.45 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.053 -173.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -61.06 -35.52 65.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.243 -178.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -107.14 35.97 4.69 Favored Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 176.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.756 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 15.6 m -145.84 -9.29 0.54 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.409 -0.395 . . . . 0.0 111.263 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -81.18 126.11 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.12 -179.33 6.95 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.336 0.589 . . . . 0.0 112.061 -169.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.433 ' O ' HD13 ' A' ' 81' ' ' LEU . 7.8 t -136.86 141.07 42.78 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.124 172.508 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -122.61 151.66 41.23 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.082 -178.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -135.71 157.05 47.81 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.66 135.54 7.8 Favored Pre-proline 0 C--N 1.33 -0.252 0 O-C-N 124.05 0.843 . . . . 0.0 110.922 177.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -49.91 -38.68 48.78 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.589 2.859 . . . . 0.0 113.609 -174.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.45 -8.86 54.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.973 0.416 . . . . 0.0 111.663 -177.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -109.13 -35.37 6.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.143 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -42.22 81.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.611 0.72 . . . . 0.0 110.259 175.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -95.27 15.46 19.22 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.531 -178.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -58.72 -32.3 69.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.886 178.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.993 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 24.7 t70 -108.4 136.1 48.6 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.672 174.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -25.28 65.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.733 0.301 . . . . 0.0 111.573 -176.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.3 tp -91.78 -22.85 19.94 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.956 178.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.993 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.1 OUTLIER -55.92 -46.45 78.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.273 -178.362 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.568 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -61.8 -24.2 66.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.039 0.447 . . . . 0.0 111.358 -179.261 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -96.03 -5.89 59.37 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.579 -0.819 . . . . 0.0 111.74 177.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.806 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 1.3 tp -83.96 -33.52 24.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.826 0.346 . . . . 0.0 110.194 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.568 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.3 OUTLIER -73.86 -32.54 63.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.362 178.334 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.659 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -84.9 69.04 3.39 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.551 -0.833 . . . . 0.0 111.996 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.27 55.46 2.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.419 0.628 . . . . 0.0 109.812 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 141.27 -112.42 0.77 Allowed Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.611 -0.996 . . . . 0.0 110.611 -175.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.72 60.29 1.03 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.159 0.504 . . . . 0.0 110.215 175.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.659 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 0.2 OUTLIER -87.08 142.13 28.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.165 178.768 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.564 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 1.0 OUTLIER -111.59 -178.0 3.33 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.382 -176.742 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -109.84 -155.12 15.34 Favored Glycine 0 C--O 1.227 -0.305 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.148 -175.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.483 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -65.7 146.45 54.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.794 0.33 . . . . 0.0 110.64 176.838 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.9 m -66.09 93.15 0.19 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.778 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 109.83 -58.87 0.37 Allowed Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.868 -178.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -71.71 99.43 2.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.034 0.445 . . . . 0.0 110.615 -179.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.73 70.27 8.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.394 0.616 . . . . 0.0 110.586 179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -166.72 -54.47 0.03 OUTLIER Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.536 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.69 120.28 14.43 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 175.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.507 ' HB1' HD13 ' A' ' 51' ' ' LEU . . . -115.74 142.16 47.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.559 -178.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.497 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 1.0 OUTLIER -110.98 128.95 56.01 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.593 -178.407 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 1.036 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -111.63 140.5 46.2 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.013 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.719 ' HD2' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -94.69 174.65 7.0 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.32 -174.733 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.26 -31.36 71.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.104 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.474 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.9 OUTLIER -67.13 -36.31 81.62 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.702 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.527 HD13 ' HA ' ' A' ' 72' ' ' LEU . 0.1 OUTLIER -75.24 -36.16 61.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.494 178.788 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.8 mt -61.51 -41.73 91.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.295 0.569 . . . . 0.0 109.641 175.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -77.22 -7.36 55.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.001 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' A' ' 71' ' ' SER . 2.0 tp-100 -95.03 -54.35 3.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.873 -177.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.806 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -122.87 -6.4 8.49 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -173.148 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 65.79 49.74 57.46 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.546 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.4 mp -70.95 97.5 1.44 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.735 0.302 . . . . 0.0 111.516 -176.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.911 ' HA ' HG12 ' A' ' 82' ' ' VAL . 0.0 OUTLIER -86.86 18.51 3.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.932 0.396 . . . . 0.0 111.323 179.743 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.4 -26.36 35.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.895 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 1.036 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.1 OUTLIER -126.03 -4.34 6.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.647 -178.309 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.911 HG12 ' HA ' ' A' ' 79' ' ' LEU . 1.9 p -104.68 141.33 20.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.21 0.529 . . . . 0.0 110.704 -177.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -129.37 174.92 9.18 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.465 177.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -133.67 107.76 8.14 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.951 0.405 . . . . 0.0 111.049 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.498 ' C ' ' H ' ' A' ' 87' ' ' GLU . 17.5 p -79.97 -168.82 1.76 Allowed 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 173.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -75.9 28.02 0.11 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.165 0.507 . . . . 0.0 110.403 173.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.498 ' H ' ' C ' ' A' ' 85' ' ' THR . 1.4 mm-40 -126.39 -101.32 0.37 Allowed 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.501 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -135.58 -158.83 8.36 Favored Glycine 0 N--CA 1.445 -0.71 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 178.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -69.01 117.84 5.29 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.552 2.168 . . . . 0.0 111.12 176.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.512 HG12 ' HB2' ' A' ' 18' ' ' PHE . 2.5 m -129.14 170.89 17.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.174 0.511 . . . . 0.0 111.74 -173.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.4 t -67.82 118.86 11.62 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.167 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 35.7 tttp -69.27 -30.15 68.2 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.114 -178.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.417 ' HB3' ' H ' ' A' ' 94' ' ' ILE . 0.6 OUTLIER -152.29 -105.84 0.05 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.142 0.496 . . . . 0.0 111.989 -173.407 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.443 HG23 ' HB3' ' A' ' 109' ' ' ASP . 3.7 mt -76.61 126.6 37.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.781 -168.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -91.7 132.22 36.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 175.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.497 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . . . -152.87 158.91 42.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.969 -176.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -105.85 116.71 32.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.966 0.412 . . . . 0.0 110.01 179.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.756 ' O ' ' HA ' ' A' ' 31' ' ' SER . 5.6 t -129.5 117.31 18.64 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.083 -173.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -73.71 146.1 37.9 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 122.648 2.232 . . . . 0.0 112.748 -178.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.3 129.11 35.9 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 173.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 130.09 -60.89 0.67 Allowed Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.792 -0.718 . . . . 0.0 111.91 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -169.36 174.79 5.85 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 122.917 0.487 . . . . 0.0 109.949 176.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 17.2 m 79.42 144.86 0.08 Allowed 'General case' 0 N--CA 1.462 0.159 0 O-C-N 124.043 0.84 . . . . 0.0 111.942 176.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.564 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -70.67 176.02 4.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.491 -1.231 . . . . 0.0 111.185 -178.049 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.471 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -110.96 141.96 43.7 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.898 -176.151 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 3.3 m -88.07 145.75 7.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.289 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.92 121.45 45.27 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.891 0.377 . . . . 0.0 111.084 -177.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.28 30.52 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.564 177.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . 0.443 ' HB3' HG23 ' A' ' 94' ' ' ILE . 34.3 p-10 . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.409 -175.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.469 0.512 0 CA-C-O 121.147 0.499 . . . . 0.0 110.834 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.14 -32.88 5.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.31 0.576 . . . . 0.0 110.221 178.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.29 -22.02 45.21 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.895 178.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.11 76.23 6.86 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.599 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.8 -28.36 65.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.315 0.579 . . . . 0.0 110.076 175.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.468 ' HB3' HG11 ' A' ' 90' ' ' VAL . . . -64.64 -33.44 75.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.397 177.032 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -72.67 -30.88 64.64 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.51 -38.28 86.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.939 174.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' A' ' 17' ' ' ALA . 1.4 mtpp -69.97 -36.88 75.55 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.688 0.756 . . . . 0.0 109.072 175.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.91 -25.24 68.06 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.787 176.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.459 ' HA ' HD11 ' A' ' 32' ' ' ILE . . . -68.61 -14.96 63.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.45 . . . . 0.0 112.019 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -110.6 9.4 23.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.096 0.474 . . . . 0.0 110.383 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.28 -12.5 73.15 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 175.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.3 m -151.83 139.97 20.24 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 176.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.73 97.29 1.06 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.639 0.257 . . . . 0.0 110.97 -179.109 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.8 m -149.21 165.59 31.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.123 -177.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.533 ' O ' ' HB ' ' A' ' 32' ' ' ILE . 21.2 m120 -115.83 174.7 5.89 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 t -55.6 -42.99 71.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -178.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.24 9.43 72.22 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.423 -0.894 . . . . 0.0 113.131 -176.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.498 ' OG ' ' HB2' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -131.57 2.71 4.15 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.139 0.495 . . . . 0.0 110.958 -179.82 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.533 ' HB ' ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -89.8 132.7 33.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.577 -179.484 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.705 ' HB2' ' HD2' ' A' ' 69' ' ' LYS . . . -145.07 156.16 43.75 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.485 0.659 . . . . 0.0 111.791 -175.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.3 t -108.64 130.85 55.32 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 115.107 -0.951 . . . . 0.0 108.514 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.643 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 60.1 m -116.68 154.43 30.6 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -178.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.63 ' OD1' ' HB ' ' A' ' 41' ' ' THR . 12.7 p30 -152.3 159.19 43.53 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.519 177.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.433 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.9 OUTLIER -54.88 133.42 66.7 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.733 176.633 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.709 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 54.8 Cg_exo -49.86 -31.42 26.53 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.557 2.838 . . . . 0.0 113.607 -172.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.25 -19.93 49.92 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -177.012 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.96 -53.18 3.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.772 -177.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.63 ' HB ' ' OD1' ' A' ' 36' ' ' ASN . 0.4 OUTLIER -69.4 -25.07 63.96 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.541 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.709 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.4 m-80 -91.98 15.78 12.5 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.041 -177.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -49.4 -33.73 14.56 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.894 -179.175 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.782 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 6.2 t70 -119.3 152.35 36.87 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.0 -24.32 40.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.396 -175.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 tp -85.36 -36.28 20.85 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 175.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.782 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -52.3 -39.88 61.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.542 175.983 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.06 -18.25 65.14 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.145 -177.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -97.32 -25.88 10.63 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.065 -0.588 . . . . 0.0 111.837 176.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 94.2 mt -75.68 -9.04 58.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.771 0.319 . . . . 0.0 110.778 179.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.461 HD21 HG23 ' A' ' 41' ' ' THR . 0.1 OUTLIER -65.81 -13.53 59.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.007 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.433 ' HA3' ' HB2' ' A' ' 56' ' ' LEU . . . -148.91 94.05 0.15 Allowed Glycine 0 N--CA 1.444 -0.815 0 N-CA-C 111.228 -0.749 . . . . 0.0 111.228 176.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.466 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -81.42 63.46 5.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.02 0.438 . . . . 0.0 111.459 -171.648 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 154.49 52.94 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.546 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 60.75 43.69 11.95 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.919 0.39 . . . . 0.0 111.619 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.727 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 0.1 OUTLIER -85.95 -174.36 5.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.935 0.398 . . . . 0.0 111.084 179.712 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.525 ' H ' HD23 ' A' ' 56' ' ' LEU . 10.5 t-20 -132.88 -178.28 4.88 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.201 -178.478 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.545 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -107.42 -146.3 12.73 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.717 -0.674 . . . . 0.0 112.156 -177.282 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 12.9 tp -65.69 145.96 55.38 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.0 t -53.93 109.77 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.842 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.29 -51.08 4.44 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.81 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 24.6 t30 -81.32 94.35 6.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.307 0.575 . . . . 0.0 111.172 -176.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.73 129.08 38.68 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.324 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 131.95 -51.17 0.86 Allowed Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.793 178.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.89 68.82 7.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.878 0.371 . . . . 0.0 110.95 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.545 ' HA ' ' HA2' ' A' ' 58' ' ' GLY . . . -79.95 137.77 36.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.745 176.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.3 m -110.83 141.51 44.09 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.109 0.48 . . . . 0.0 111.774 -174.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.905 ' HB3' HD22 ' A' ' 81' ' ' LEU . . . -104.76 156.16 18.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.905 178.165 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.705 ' HD2' ' HB2' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -111.7 -178.42 3.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.201 -172.939 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.61 -37.96 83.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.695 0.283 . . . . 0.0 111.342 -177.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -41.39 94.9 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.473 0.654 . . . . 0.0 110.103 177.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.545 ' HA ' ' NE2' ' A' ' 75' ' ' GLN . 1.1 mp -72.57 -17.08 61.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.162 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -66.03 -34.09 67.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 173.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -101.01 -39.33 7.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.55 -174.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.545 ' NE2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -51.8 -29.68 20.08 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -174.8 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.482 HD13 ' HA ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -147.14 -17.82 0.4 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 111.871 0.322 . . . . 0.0 111.871 -178.479 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.41 51.96 5.01 Favored Glycine 0 CA--C 1.519 0.304 0 C-N-CA 119.935 -1.126 . . . . 0.0 112.406 178.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.02 84.62 0.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.107 0.479 . . . . 0.0 111.018 -178.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.451 ' HG ' ' H ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -69.55 -6.24 29.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.565 -174.693 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -77.72 -16.49 58.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.825 0.345 . . . . 0.0 110.735 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.905 HD22 ' HB3' ' A' ' 68' ' ' ALA . 0.4 OUTLIER -105.54 -25.09 12.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.517 -175.907 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.44 138.85 24.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.0 0.428 . . . . 0.0 111.007 -177.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.454 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 5.8 t70 -117.85 159.26 23.37 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 174.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.508 ' CE1' ' HA2' ' A' ' 88' ' ' GLY . 23.8 t-80 -111.58 110.91 21.56 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.204 0.526 . . . . 0.0 110.858 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.3 p -97.07 -167.81 1.6 Allowed 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.093 177.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.435 ' HG3' ' H ' ' A' ' 86' ' ' GLU . 16.6 mt-10 -51.12 -44.06 61.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.531 177.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.413 ' CD ' ' HB2' ' A' ' 17' ' ' ALA . 48.9 mp0 -72.83 -75.42 0.14 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.842 0.353 . . . . 0.0 111.148 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.508 ' HA2' ' CE1' ' A' ' 84' ' ' HIS . . . -168.65 -151.48 7.18 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.617 -176.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -69.82 107.9 1.97 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 123.128 2.552 . . . . 0.0 111.703 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.468 HG11 ' HB3' ' A' ' 17' ' ' ALA . 1.0 OUTLIER -125.61 -173.3 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.014 -176.726 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 50.1 t -67.72 134.13 50.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.41 177.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.454 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttt -73.65 -36.04 65.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.792 -178.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.522 ' HB3' HG13 ' A' ' 94' ' ' ILE . 4.8 m-80 -146.66 -95.22 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -171.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.522 HG13 ' HB3' ' A' ' 93' ' ' ASN . 3.5 mt -93.57 132.86 36.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.888 -168.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.49 130.82 36.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.501 177.03 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.643 ' HB3' ' SG ' ' A' ' 35' ' ' CYS . . . -154.52 175.8 13.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.051 0.453 . . . . 0.0 111.476 -178.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.97 125.69 54.68 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.555 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.621 ' HB3' ' HD2' ' A' ' 69' ' ' LYS . 15.3 t -144.22 129.01 9.38 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.18 -176.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.469 ' O ' HD21 ' A' ' 56' ' ' LEU . 67.5 Cg_endo -87.86 129.83 2.56 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 122.95 2.433 . . . . 0.0 112.818 -176.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.687 ' HG2' ' HE2' ' A' ' 69' ' ' LYS . 4.7 mm-40 -77.31 97.28 4.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.109 0.48 . . . . 0.0 110.691 176.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.463 ' O ' ' HB ' ' A' ' 102' ' ' THR . . . 169.67 -53.01 0.2 Allowed Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 177.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.727 ' HA ' ' HA ' ' A' ' 56' ' ' LEU . 5.8 t 177.07 -176.33 0.14 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 71.95 158.96 0.2 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.343 0.592 . . . . 0.0 111.099 -176.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.497 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 1.0 OUTLIER -76.17 173.88 10.79 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.498 -175.755 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.5 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -111.25 150.65 29.3 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.931 -179.467 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.467 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 6.0 m -106.6 133.48 51.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.891 0.377 . . . . 0.0 110.64 -177.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.98 119.55 39.67 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.316 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -114.28 13.44 8.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.062 0.458 . . . . 0.0 110.765 -178.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.324 -0.526 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.312 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.468 ' HA ' HD22 ' A' ' 12' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.354 0 CA-C-O 121.107 0.479 . . . . 0.0 110.314 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.68 -28.72 69.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.629 -179.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.06 -27.06 61.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.184 0.516 . . . . 0.0 111.074 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -88.22 68.17 8.94 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.448 -176.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.51 -31.47 69.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.6 -29.45 70.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.934 174.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.584 ' HB2' HG12 ' A' ' 90' ' ' VAL . 69.9 t80 -84.47 -29.62 25.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.974 0.416 . . . . 0.0 110.466 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.43 -4.46 22.65 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.975 -178.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.47 -24.78 31.64 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 176.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.542 ' HG2' HG21 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -73.32 -27.34 61.47 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.858 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.12 -11.27 60.77 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.846 178.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -101.8 -47.54 4.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.103 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -72.08 -44.87 43.66 Favored Glycine 0 C--N 1.33 0.199 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.8 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.36 136.4 32.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.742 0.306 . . . . 0.0 110.918 -178.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.74 96.0 7.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.882 0.372 . . . . 0.0 111.618 -177.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.428 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 98.9 m -144.47 -178.85 6.19 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 176.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 31.8 t30 -102.66 134.78 45.46 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.4 p -62.57 -29.27 46.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 O-C-N 123.214 0.321 . . . . 0.0 111.334 -177.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -88.84 8.35 79.77 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.734 -0.746 . . . . 0.0 111.754 177.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.3 m -149.63 42.94 0.91 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.084 0.468 . . . . 0.0 110.408 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -97.65 140.14 18.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 176.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.479 ' CB ' ' HB3' ' A' ' 98' ' ' CYS . . . -148.67 160.88 42.73 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 121.194 0.521 . . . . 0.0 111.717 -173.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 21.5 m -114.6 131.98 56.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.158 173.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.429 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 2.8 m -122.23 164.94 16.98 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.297 -178.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.573 ' HB2' HD12 ' A' ' 81' ' ' LEU . 1.1 t30 -147.42 159.91 43.17 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.258 -179.571 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.05 142.1 37.1 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.786 175.103 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.508 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 83.9 Cg_exo -47.6 -44.84 24.99 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.858 3.038 . . . . 0.0 114.73 -173.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.47 -15.32 62.53 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -173.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.569 ' CD ' ' HZ1' ' A' ' 92' ' ' LYS . 4.7 mt-10 -98.59 -48.52 4.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.539 0.685 . . . . 0.0 109.631 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.416 HG22 HD22 ' A' ' 51' ' ' LEU . 3.6 m -61.13 -34.6 75.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.11 177.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.508 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.1 m-80 -104.93 15.2 28.17 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.779 -177.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -53.83 -40.16 66.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.481 -177.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 1.095 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.1 t70 -102.66 146.93 27.46 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.74 -179.343 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -34.19 77.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.86 -177.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 46' ' ' LEU . 6.3 tp -92.28 -24.29 19.02 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.089 0.471 . . . . 0.0 110.736 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 1.095 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -58.85 -31.76 68.82 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.515 -177.613 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.44 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -63.01 -11.76 21.28 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -176.537 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -117.42 -21.49 4.37 Favored Glycine 0 C--N 1.331 0.301 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 172.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.2 mp -84.3 -7.21 59.4 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.708 ' HA ' ' HG ' ' A' ' 78' ' ' LEU . 0.3 OUTLIER -70.55 -9.0 55.7 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.301 0.572 . . . . 0.0 109.975 179.08 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.637 ' HA2' HD23 ' A' ' 72' ' ' LEU . . . -128.44 -125.99 2.82 Favored Glycine 0 N--CA 1.438 -1.224 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 176.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -168.76 -24.6 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.358 0.599 . . . . 0.0 109.669 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -126.1 -157.98 9.76 Favored Glycine 0 N--CA 1.443 -0.878 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 172.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.459 ' O ' HG22 ' A' ' 102' ' ' THR . 0.2 OUTLIER -75.53 64.79 1.67 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.182 0.515 . . . . 0.0 110.927 179.761 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.701 ' HA ' ' O ' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -65.55 150.62 48.1 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.778 178.294 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -109.22 177.89 4.62 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 171.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -110.18 -154.18 14.38 Favored Glycine 0 CA--C 1.504 -0.603 0 C-N-CA 120.361 -0.923 . . . . 0.0 111.993 -173.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.683 ' HB3' ' HB2' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -65.46 139.54 58.52 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 178.37 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.2 m -56.77 96.48 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.5 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.11 19.12 56.46 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.883 178.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.683 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 1.1 t-20 -127.92 95.03 4.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.182 0.515 . . . . 0.0 109.92 178.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.33 88.4 3.14 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.612 -176.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 153.96 -43.74 0.6 Allowed Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.968 -0.634 . . . . 0.0 111.798 176.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.6 98.94 7.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.947 0.404 . . . . 0.0 110.675 179.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.51 171.58 9.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.982 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 79.4 m -134.68 140.08 45.73 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.273 -175.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -104.81 124.73 49.94 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.51 ' HG2' ' H ' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -85.19 157.17 20.71 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.259 -175.465 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.84 -36.31 72.11 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 m -63.55 -31.91 73.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.191 0.52 . . . . 0.0 110.44 176.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.714 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 0.3 OUTLIER -85.88 -18.82 31.72 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.897 -177.57 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.77 -37.98 81.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 172.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -79.8 -6.84 58.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.667 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.799 ' HB3' HD12 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -95.1 -42.3 8.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.245 -178.137 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.799 HD12 ' HB3' ' A' ' 75' ' ' GLN . 4.2 mp -134.79 -65.52 0.63 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.767 -177.437 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.58 50.27 1.86 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.35 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.708 ' HG ' ' HA ' ' A' ' 51' ' ' LEU . 1.8 mm? -59.66 107.03 0.54 Allowed 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 122.613 0.365 . . . . 0.0 110.797 -178.571 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.435 ' HG ' ' H ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.58 17.1 0.16 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.428 -171.941 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -93.13 -29.23 15.87 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.225 0.536 . . . . 0.0 109.659 173.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.573 HD12 ' HB2' ' A' ' 36' ' ' ASN . 0.5 OUTLIER -105.11 -1.7 25.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.664 -173.016 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.489 ' C ' ' HG2' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -123.6 137.61 56.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.292 0.568 . . . . 0.0 111.295 -178.955 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -90.19 174.06 7.82 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 173.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.7 72.28 1.4 Allowed 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 122.039 0.923 . . . . 0.0 110.508 -176.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 98.0 m -72.76 158.57 35.32 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 114.099 -1.409 . . . . 0.0 109.665 175.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -53.43 -35.59 60.62 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -177.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.03 -63.82 1.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.468 0.652 . . . . 0.0 110.327 177.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -173.37 -174.56 40.49 Favored Glycine 0 N--CA 1.44 -1.072 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -69.96 132.34 22.81 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.032 1.821 . . . . 0.0 110.846 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.584 HG12 ' HB2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -133.57 -178.53 2.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.934 -169.411 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.43 133.7 50.04 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.256 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.569 ' HZ1' ' CD ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -71.67 -46.84 57.66 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 -177.074 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -150.68 -70.54 0.18 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.837 -171.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.416 ' HB ' ' HB2' ' A' ' 35' ' ' CYS . 15.7 mt -98.88 120.91 48.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.183 -174.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.542 HG21 ' HG2' ' A' ' 21' ' ' GLN . 7.6 p -93.51 129.96 43.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.125 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.429 ' HB3' ' SG ' ' A' ' 35' ' ' CYS . . . -148.81 169.72 19.84 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.398 0.618 . . . . 0.0 111.561 -174.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.428 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -105.16 115.97 31.17 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.217 175.561 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.491 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 38.9 t -136.38 126.3 16.08 Favored Pre-proline 0 C--N 1.319 -0.723 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.87 -173.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -67.21 134.38 33.61 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.721 2.281 . . . . 0.0 111.462 178.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.451 ' HA ' ' HG3' ' A' ' 69' ' ' LYS . 1.3 tt0 -67.03 118.23 10.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.106 0.479 . . . . 0.0 109.894 176.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.701 ' O ' ' HA ' ' A' ' 56' ' ' LEU . . . 113.9 -115.93 3.73 Favored Glycine 0 N--CA 1.437 -1.296 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -176.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.459 HG22 ' O ' ' A' ' 55' ' ' LEU . 66.8 p -98.83 -174.84 2.89 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 123.659 0.27 . . . . 0.0 110.802 -173.071 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.1 m 74.07 151.67 0.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.686 0.755 . . . . 0.0 112.058 177.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -76.34 159.77 30.22 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.027 -175.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.491 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.4 141.41 46.17 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.893 -179.75 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.42 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 1.7 m -99.37 135.2 35.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.164 0.507 . . . . 0.0 111.185 -178.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -100.52 112.01 24.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.537 176.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 1.8 m -94.45 21.71 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -170.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.1 t0 . . . . . 0 C--N 1.32 -0.692 0 CA-C-O 121.34 0.59 . . . . 0.0 111.108 177.381 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.475 0.805 0 CA-C-O 120.913 0.387 . . . . 0.0 110.94 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.407 HD22 ' HA ' ' A' ' 2' ' ' LEU . 0.2 OUTLIER -132.97 98.64 15.69 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -178.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -64.3 132.34 33.45 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.897 2.398 . . . . 0.0 113.199 -175.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 65.19 47.36 2.45 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.243 173.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 p -111.4 100.9 9.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.02 175.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.04 16.93 9.71 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.717 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -93.71 116.46 28.95 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.784 -178.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.01 18.72 20.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.304 0.573 . . . . 0.0 109.997 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -124.51 141.34 52.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.182 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -134.79 49.46 2.22 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.102 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.3 mttm -95.94 -176.0 3.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.231 -178.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.492 ' C ' ' H ' ' A' ' 14' ' ' THR . 7.8 mp -81.39 58.94 3.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.783 -0.189 . . . . 0.0 110.905 -176.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 68.96 -33.4 0.24 Allowed 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.362 0.665 . . . . 0.0 111.536 -177.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.492 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -153.62 -51.36 0.1 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.066 178.146 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.4 m 66.73 -78.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.813 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 52.23 -87.71 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.636 0.585 . . . . 0.0 110.964 -177.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.745 ' HB1' ' HD2' ' A' ' 116' ' ' LYS . . . -60.09 -39.01 84.62 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.63 174.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -69.18 -25.75 64.5 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.044 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.59 -40.28 66.69 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.942 175.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.584 ' NZ ' ' HB2' ' A' ' 118' ' ' GLU . 0.2 OUTLIER -62.83 -35.72 80.84 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 174.127 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.662 ' HG3' ' HB3' ' A' ' 116' ' ' LYS . 1.0 OUTLIER -61.47 -46.9 88.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.211 174.365 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.83 -18.28 64.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.739 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.08 -33.92 13.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.87 178.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.66 -24.4 58.5 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.3 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.71 133.47 52.75 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.801 0.334 . . . . 0.0 110.345 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.33 96.55 4.64 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.104 0.478 . . . . 0.0 111.383 -178.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.4 m -142.04 -177.78 5.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.057 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -117.2 157.34 26.17 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.288 -179.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.419 HG22 ' H ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -68.36 -48.54 72.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -173.555 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.37 9.37 61.58 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.812 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 m -139.57 31.4 2.08 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.164 0.507 . . . . 0.0 110.034 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -90.54 127.93 42.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.383 -179.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.88 169.11 21.27 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.085 0.469 . . . . 0.0 111.474 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.432 ' O ' HD22 ' A' ' 81' ' ' LEU . 8.8 t -125.72 140.12 52.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.194 172.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.605 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 0.3 OUTLIER -121.91 138.99 54.19 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.639 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.492 HD22 ' HB2' ' A' ' 40' ' ' GLU . 10.1 t30 -116.16 160.18 20.73 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.77 -179.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.91 126.92 3.22 Favored Pre-proline 0 C--O 1.237 0.443 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.111 172.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.46 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 7.9 Cg_endo -49.69 -38.74 46.74 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.909 3.072 . . . . 0.0 114.198 -171.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.74 -23.96 66.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.758 0.313 . . . . 0.0 111.666 -175.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.492 ' HB2' HD22 ' A' ' 36' ' ' ASN . 51.2 mm-40 -96.49 -41.76 8.42 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 0.0 110.27 -178.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.451 ' HA ' ' HB1' ' A' ' 80' ' ' ALA . 2.0 m -62.44 -33.65 75.24 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.447 0.641 . . . . 0.0 110.468 175.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.6 OUTLIER -104.13 16.01 27.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.5 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -52.97 -48.58 67.31 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.212 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 1.001 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 7.4 t70 -94.53 136.12 35.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.885 175.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -27.44 67.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.103 0.478 . . . . 0.0 110.493 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.01 -26.4 29.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.251 178.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 1.001 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -60.13 -37.06 78.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.331 178.39 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.32 -34.07 70.19 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.09 179.043 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -94.11 -12.91 55.83 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.104 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -77.01 -33.98 57.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.022 0.439 . . . . 0.0 110.664 -178.217 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.453 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.6 OUTLIER -73.43 -30.22 63.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.151 0.5 . . . . 0.0 110.748 179.162 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.664 ' HA2' ' HG ' ' A' ' 56' ' ' LEU . . . -91.31 60.44 2.97 Favored Glycine 0 N--CA 1.443 -0.898 0 C-N-CA 121.058 -0.592 . . . . 0.0 112.429 -177.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.81 -24.86 67.92 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.91 0.386 . . . . 0.0 111.034 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -118.12 22.71 9.59 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.542 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.592 ' O ' HG23 ' A' ' 102' ' ' THR . 21.4 tp 66.27 44.18 2.57 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.162 0.506 . . . . 0.0 110.624 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.664 ' HG ' ' HA2' ' A' ' 52' ' ' GLY . 0.2 OUTLIER -86.07 178.28 7.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.091 -177.648 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -120.06 -176.08 3.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.744 -175.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -100.92 -154.36 26.81 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.295 -174.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.573 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 8.2 tp -66.68 140.38 57.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.831 0.316 . . . . 0.0 110.537 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.65 97.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.723 -178.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 103.16 -10.36 54.88 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.875 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.573 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 23.7 t30 -129.27 93.55 3.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.187 0.518 . . . . 0.0 110.85 -178.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 28.6 m -75.1 93.77 2.81 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.712 176.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 173.4 -58.01 0.14 Allowed Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 178.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.44 84.01 5.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.979 0.418 . . . . 0.0 110.208 177.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.63 155.89 29.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.054 177.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.7 m -122.33 131.53 53.95 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.891 0.377 . . . . 0.0 111.422 -177.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.711 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -105.13 134.57 48.01 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.879 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.828 ' HD2' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -89.2 167.19 13.29 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.703 -174.066 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.483 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -58.98 -32.87 70.05 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.413 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -37.85 71.2 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.413 0.625 . . . . 0.0 109.519 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.421 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -65.8 -31.93 73.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.046 175.719 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.483 HD12 ' HA ' ' A' ' 70' ' ' ALA . 3.9 mt -65.37 -35.67 75.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.318 177.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -84.08 -6.49 59.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.064 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.78 -43.86 8.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.292 0.568 . . . . 0.0 109.9 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.2 mp -132.43 -53.87 0.96 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.562 -176.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.18 51.17 2.28 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.034 -179.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.524 ' H ' HD22 ' A' ' 78' ' ' LEU . 1.9 mm? -54.04 100.45 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 122.683 0.393 . . . . 0.0 111.432 -177.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.488 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -76.17 1.72 15.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.55 -176.426 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.451 ' HB1' ' HA ' ' A' ' 41' ' ' THR . . . -72.28 -33.64 67.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.917 0.389 . . . . 0.0 110.946 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.711 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.8 OUTLIER -119.61 4.53 11.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.916 0.389 . . . . 0.0 111.431 -176.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.601 HG23 HD12 ' A' ' 81' ' ' LEU . 97.0 t -109.0 138.8 34.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.887 178.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.896 ' HB2' ' HD3' ' A' ' 92' ' ' LYS . 29.2 t70 -123.43 153.19 40.77 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -118.14 132.35 56.35 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.4 0.619 . . . . 0.0 111.586 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.476 HG23 ' H ' ' A' ' 87' ' ' GLU . 11.7 t -138.66 174.76 10.19 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.812 -1.085 . . . . 0.0 108.111 174.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -68.43 -16.79 64.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.336 0.589 . . . . 0.0 110.716 -178.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.476 ' H ' HG23 ' A' ' 85' ' ' THR . 40.3 mp0 -77.64 -5.48 50.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.553 176.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 114.69 -174.38 15.39 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.188 -0.529 . . . . 0.0 112.652 177.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -65.85 119.75 6.82 Favored 'Trans proline' 0 N--CA 1.463 -0.274 0 C-N-CA 123.037 2.491 . . . . 0.0 111.18 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 3.0 m -133.25 179.91 3.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.921 0.391 . . . . 0.0 111.528 -172.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.57 146.41 50.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.821 177.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.896 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -86.3 -37.52 18.45 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.327 175.424 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.426 ' O ' ' HA3' ' A' ' 114' ' ' GLY . 6.1 m-80 -150.57 -87.29 0.07 Allowed 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 120.929 0.395 . . . . 0.0 111.601 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 4.7 mt -92.94 131.27 40.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.563 -169.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.6 p -100.14 132.1 46.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.511 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.605 ' HB3' ' SG ' ' A' ' 35' ' ' CYS . . . -154.33 167.12 31.03 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 120.834 0.35 . . . . 0.0 111.449 -177.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.79 126.35 52.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.019 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.828 ' HB3' ' HD2' ' A' ' 69' ' ' LYS . 11.5 t -135.93 134.35 20.42 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.137 -171.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -82.78 142.75 11.49 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 122.898 2.398 . . . . 0.0 113.042 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -81.23 125.44 30.3 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 169.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 134.72 -113.37 1.13 Allowed Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -175.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -146.85 105.49 3.82 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 117.136 0.468 . . . . 0.0 111.874 179.279 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 171.73 168.64 0.1 Allowed 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 124.813 1.245 . . . . 0.0 108.764 172.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -80.07 171.45 15.07 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.418 -178.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.4 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.04 143.39 43.13 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.272 -178.822 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.467 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 3.7 m -95.26 136.54 25.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.712 -177.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.549 ' HB2' HD11 ' A' ' 59' ' ' LEU . . . -111.07 124.14 51.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.058 0.456 . . . . 0.0 111.135 -177.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -105.89 11.27 8.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.273 -178.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -115.53 -81.06 0.61 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.003 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 76.67 -53.54 0.58 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.815 0.846 . . . . 0.0 112.307 174.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.17 23.52 7.66 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.848 -175.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -109.68 -14.3 14.42 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.486 -0.864 . . . . 0.0 111.99 178.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . 72.15 22.4 3.65 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.516 0.726 . . . . 0.0 111.511 176.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . 0.426 ' HA3' ' O ' ' A' ' 93' ' ' ASN . . . 56.64 54.94 32.61 Favored Glycine 0 C--N 1.331 0.257 0 CA-C-N 116.07 -0.514 . . . . 0.0 113.287 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 4.9 t -83.0 154.04 24.66 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.0 0.428 . . . . 0.0 110.546 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.745 ' HD2' ' HB1' ' A' ' 17' ' ' ALA . 0.0 OUTLIER -130.72 145.47 51.95 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.753 178.081 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -71.51 95.81 1.44 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.393 0.433 . . . . 0.0 110.043 177.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.584 ' HB2' ' NZ ' ' A' ' 20' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.532 -175.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 120.619 0.247 . . . . 0.0 111.024 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.26 117.75 52.54 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-O 120.976 0.417 . . . . 0.0 110.484 179.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -79.23 3.38 7.5 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 122.64 2.227 . . . . 0.0 112.754 -178.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -100.17 -9.9 22.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.381 -178.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.91 -59.37 2.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.874 0.369 . . . . 0.0 111.284 -179.087 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.61 -113.4 0.21 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.348 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 63.7 21.38 12.67 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 123.529 0.518 . . . . 0.0 111.323 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -129.76 30.87 4.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.235 -177.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -101.13 -88.38 0.37 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.718 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -153.22 89.91 1.39 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.931 0.396 . . . . 0.0 110.854 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.2 138.55 33.58 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.24 178.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.463 HD11 ' HD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -94.48 71.5 3.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.307 0.575 . . . . 0.0 109.671 177.305 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -155.66 -46.81 0.08 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.09 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.95 -22.01 60.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.142 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.409 ' HB3' ' O ' ' A' ' 89' ' ' PRO . 0.0 OUTLIER -78.68 64.07 3.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.289 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.39 -31.88 70.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.225 0.536 . . . . 0.0 110.409 178.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 1.0 ' HB1' ' HB2' ' A' ' 116' ' ' LYS . . . -65.76 -31.48 72.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.147 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.585 ' HA ' ' NE2' ' A' ' 21' ' ' GLN . 60.2 t80 -66.38 -40.51 89.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.016 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.67 -27.29 50.81 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.144 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.49 ' NZ ' ' HB3' ' A' ' 118' ' ' GLU . 2.9 mttm -55.67 -43.25 76.17 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.575 0.702 . . . . 0.0 109.212 173.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.585 ' NE2' ' HA ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -56.4 -49.0 75.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.346 -1.297 . . . . 0.0 111.147 175.721 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.53 ' HB1' HD11 ' A' ' 32' ' ' ILE . . . -82.92 0.61 43.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.137 -173.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -78.1 -15.08 59.2 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.753 0.311 . . . . 0.0 110.662 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.73 -8.75 55.55 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.93 -0.653 . . . . 0.0 111.806 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.31 173.95 6.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.509 0.195 . . . . 0.0 110.553 -179.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.21 97.11 5.44 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.939 0.4 . . . . 0.0 110.949 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.507 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -143.25 155.13 44.42 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.238 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -95.17 170.09 9.64 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.628 0.251 . . . . 0.0 110.635 -176.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.8 p -68.02 126.94 28.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 110.126 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.38 -33.63 5.03 Favored Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -176.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -94.23 25.97 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.218 0.532 . . . . 0.0 110.324 177.563 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.53 HD11 ' HB1' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -112.68 130.17 66.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.113 179.783 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.74 ' HB3' ' SG ' ' A' ' 98' ' ' CYS . . . -149.75 -179.63 7.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.686 0.755 . . . . 0.0 112.524 -172.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.9 t -123.42 132.96 54.11 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.245 175.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.446 ' HB2' HG12 ' A' ' 94' ' ' ILE . 3.9 m -100.36 121.29 41.27 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.853 HD21 ' HB2' ' A' ' 40' ' ' GLU . 14.3 t30 -113.56 148.0 36.94 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.469 -177.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.441 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 45.4 m -54.1 131.13 59.67 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.437 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.451 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 51.9 Cg_exo -53.27 -37.97 81.32 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.489 2.793 . . . . 0.0 114.157 -171.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.64 -18.02 65.15 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.898 0.38 . . . . 0.0 111.915 -175.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.853 ' HB2' HD21 ' A' ' 36' ' ' ASN . 5.0 mm-40 -102.43 -38.86 7.4 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.411 ' O ' HD22 ' A' ' 47' ' ' LEU . 1.8 m -62.49 -30.02 70.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.657 175.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.7 OUTLIER -104.72 13.3 31.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.045 -179.655 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -61.23 -42.3 98.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.336 0.589 . . . . 0.0 110.556 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.933 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 30.3 t0 -96.09 130.4 43.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.6 m -69.51 -23.78 63.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.091 0.472 . . . . 0.0 110.315 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -33.39 62.36 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.199 174.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.933 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -64.48 -32.39 74.0 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.416 178.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.463 ' HA ' HD21 ' A' ' 51' ' ' LEU . 4.2 t -61.65 -22.04 64.93 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.138 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -106.5 -9.87 30.28 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.439 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.699 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 1.1 mp -82.9 -23.33 33.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.921 0.391 . . . . 0.0 110.574 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.463 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.5 OUTLIER -77.34 -29.03 53.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.094 0.474 . . . . 0.0 110.33 176.503 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -98.43 83.37 0.65 Allowed Glycine 0 N--CA 1.441 -1.015 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.004 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -77.41 -6.64 54.12 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.397 0.618 . . . . 0.0 109.944 177.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.3 -126.14 1.27 Allowed Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.023 176.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.431 ' HB2' HG23 ' A' ' 102' ' ' THR . 0.0 OUTLIER -107.66 55.35 0.65 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.291 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.744 HD11 ' HZ1' ' A' ' 69' ' ' LYS . 3.3 mt -79.92 169.73 17.48 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.786 -172.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.462 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 19.4 t-20 -131.59 -179.45 5.39 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.94 175.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.579 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -99.81 -133.24 8.03 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.847 -175.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.801 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 7.9 tp -80.23 152.64 29.0 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.05 89.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.188 0.518 . . . . 0.0 111.152 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.27 -2.27 57.7 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.7 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.801 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 47.4 t30 -124.86 102.28 7.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.018 0.437 . . . . 0.0 110.877 -178.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.42 73.98 6.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.15 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.58 -55.73 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.909 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.64 79.47 4.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.03 0.443 . . . . 0.0 110.823 178.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.579 ' HA ' ' HA2' ' A' ' 58' ' ' GLY . . . -74.72 124.89 27.58 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 173.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.8 m -110.62 128.79 55.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.11 0.481 . . . . 0.0 110.271 -175.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.726 ' HB3' HD22 ' A' ' 81' ' ' LEU . . . -106.21 144.65 32.61 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.804 -174.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.744 ' HZ1' HD11 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -103.51 -174.92 2.66 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.38 -175.424 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.71 -28.57 63.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.565 -178.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -63.95 -42.31 97.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.468 0.651 . . . . 0.0 110.233 177.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.474 ' CB ' ' HB1' ' A' ' 68' ' ' ALA . 0.8 OUTLIER -77.26 -35.89 54.87 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.823 -179.95 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.417 HG12 HG21 ' A' ' 82' ' ' VAL . 3.5 mt -65.54 -37.25 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.358 -179.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -72.91 -41.32 64.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.929 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -76.4 -53.19 8.51 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.328 -173.468 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.484 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -106.19 -44.52 4.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.25 -172.839 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.94 50.24 7.07 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.194 -1.003 . . . . 0.0 112.504 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.59 106.01 0.72 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 122.332 0.253 . . . . 0.0 111.362 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.6 OUTLIER -71.01 -6.53 39.61 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.891 -177.228 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -86.74 -13.75 44.36 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.906 0.384 . . . . 0.0 110.387 177.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.726 HD22 ' HB3' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -108.62 -33.96 6.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.083 -176.331 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.417 HG21 HG12 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -108.46 137.32 40.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.69 179.805 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.431 ' O ' ' HA ' ' A' ' 89' ' ' PRO . 11.3 t70 -98.18 176.01 5.88 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 175.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.91 112.19 7.32 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.946 0.403 . . . . 0.0 111.285 -175.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.473 ' HB ' ' OE1' ' A' ' 86' ' ' GLU . 1.2 p -118.82 -167.64 1.41 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.802 177.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.473 ' OE1' ' HB ' ' A' ' 85' ' ' THR . 0.0 OUTLIER -66.16 -33.27 75.39 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 177.588 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.41 ' CD ' ' HB2' ' A' ' 17' ' ' ALA . 28.0 mt-10 -80.02 4.8 15.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.437 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 103.8 -155.48 17.75 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.764 173.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.431 ' HA ' ' O ' ' A' ' 83' ' ' ASP . 73.2 Cg_endo -73.4 126.13 10.73 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.876 2.384 . . . . 0.0 111.27 177.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -133.12 175.07 12.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.29 -173.137 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.07 116.96 9.29 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.997 178.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.5 tttp -76.19 -25.11 54.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.279 0.562 . . . . 0.0 110.433 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -133.02 -106.21 0.25 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.861 -176.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.446 HG12 ' HB2' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -113.69 149.11 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.831 0.348 . . . . 0.0 111.042 -174.18 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 1.5 t -80.87 144.75 10.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.556 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -154.2 170.2 21.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.03 0.443 . . . . 0.0 111.763 -177.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.507 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.6 m -124.33 108.42 12.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.0 177.244 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.74 ' SG ' ' HB3' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -127.85 141.71 42.0 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.243 -174.017 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -87.81 154.57 7.38 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.165 2.576 . . . . 0.0 113.099 -179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.45 ' CD ' ' HZ2' ' A' ' 69' ' ' LYS . 3.6 tp10 -98.26 117.62 33.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.401 173.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 145.06 -67.78 0.42 Allowed Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.008 177.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.431 HG23 ' HB2' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -157.4 177.33 11.55 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.561 HG22 ' H ' ' A' ' 104' ' ' ASN . 1.4 m 69.79 167.59 0.29 Allowed 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.603 0.716 . . . . 0.0 111.919 177.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.561 ' H ' HG22 ' A' ' 103' ' ' THR . 4.5 p30 -89.88 -179.29 5.69 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.542 -171.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 98' ' ' CYS . 7.2 t -112.79 148.69 34.29 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.745 -175.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.0 m -104.26 138.34 29.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.953 0.406 . . . . 0.0 110.204 178.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.86 117.79 27.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.817 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -121.49 26.41 3.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.953 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -61.23 -53.05 61.82 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.006 176.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 70.99 10.78 6.98 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 114.881 -1.054 . . . . 0.0 113.145 170.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -122.48 -42.79 2.32 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.1 0.476 . . . . 0.0 110.761 177.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 110.0 4.53 29.45 Favored Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 111.282 -0.727 . . . . 0.0 111.282 -178.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -163.79 117.35 1.49 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.461 -0.37 . . . . 0.0 110.013 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.58 -48.27 86.84 Favored Glycine 0 N--CA 1.453 -0.169 0 C-N-CA 121.27 -0.491 . . . . 0.0 112.891 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.96 98.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.273 0.629 . . . . 0.0 111.384 -179.193 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 1.0 ' HB2' ' HB1' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -72.01 -23.16 61.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.695 -179.848 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -72.57 119.09 16.31 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.433 176.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.49 ' HB3' ' NZ ' ' A' ' 20' ' ' LYS . 2.9 tm-20 . . . . . 0 C--O 1.251 1.15 0 CA-C-O 117.774 -1.107 . . . . 0.0 108.987 -177.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 120.789 0.328 . . . . 0.0 110.941 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.24 141.6 34.92 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.151 -0.315 . . . . 0.0 110.151 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.73 71.32 3.32 Favored 'Trans proline' 0 C--O 1.233 0.27 0 C-N-CA 122.645 2.23 . . . . 0.0 112.748 -179.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.92 -32.97 72.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.196 176.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.08 150.78 35.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.266 175.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -82.19 53.77 2.35 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.236 0.541 . . . . 0.0 110.849 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.21 79.85 1.27 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.29 0.567 . . . . 0.0 110.912 -178.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.45 -3.84 56.2 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.512 0.672 . . . . 0.0 109.885 178.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.1 p-10 -98.31 -35.46 10.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.971 -1.013 . . . . 0.0 111.218 -175.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -117.6 108.57 15.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.831 0.348 . . . . 0.0 111.247 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.84 157.36 46.2 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.354 178.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.02 -9.64 52.78 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.97 174.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.04 -8.7 59.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.608 -177.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.48 6.82 8.94 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.929 0.395 . . . . 0.0 111.559 -177.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 m -61.97 -50.6 71.46 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.422 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 60.72 -73.44 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.743 0.652 . . . . 0.0 112.071 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.5 -28.66 69.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.566 -178.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -62.9 -38.61 91.63 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.183 0.516 . . . . 0.0 110.257 176.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -71.58 -22.06 61.78 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.837 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.468 ' HA ' ' HG2' ' A' ' 23' ' ' GLU . 16.9 mtpp -75.65 -22.25 56.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.723 0.773 . . . . 0.0 109.052 178.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.473 ' NE2' ' HA ' ' A' ' 116' ' ' LYS . 0.5 OUTLIER -82.3 -41.95 19.45 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.522 173.621 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.44 ' HB1' HD11 ' A' ' 32' ' ' ILE . . . -74.69 -17.34 60.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.988 -1.005 . . . . 0.0 112.266 -175.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.468 ' HG2' ' HA ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -77.17 -9.2 58.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.675 0.274 . . . . 0.0 111.039 179.228 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.72 -20.04 58.8 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.669 -0.776 . . . . 0.0 112.216 177.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -125.48 123.29 38.88 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.15 97.67 1.23 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.268 0.556 . . . . 0.0 111.945 -176.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.3 m -140.85 152.52 45.18 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 173.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -84.2 153.93 23.36 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -173.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.05 -40.99 84.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -176.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.0 -8.86 86.95 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.528 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.1 10.06 12.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.033 0.444 . . . . 0.0 110.803 -178.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.44 HD11 ' HB1' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -90.24 137.94 20.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.626 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . . . -149.64 -178.69 6.58 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -170.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.533 ' HB3' ' HB2' ' A' ' 81' ' ' LEU . 4.4 t -144.43 142.15 30.11 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.278 173.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.844 ' HB2' ' HB ' ' A' ' 94' ' ' ILE . 78.6 m -113.86 158.32 21.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.839 0.352 . . . . 0.0 110.401 179.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -145.26 150.72 37.17 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -42.96 139.45 2.15 Favored Pre-proline 0 C--O 1.235 0.33 0 O-C-N 123.733 0.646 . . . . 0.0 112.436 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.517 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 70.4 Cg_exo -51.22 -54.6 5.13 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.596 2.864 . . . . 0.0 113.881 -172.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.9 -7.7 23.9 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -172.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -100.56 -51.36 3.63 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.771 0.32 . . . . 0.0 110.718 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.487 HG23 HD21 ' A' ' 51' ' ' LEU . 1.3 m -68.35 -33.3 74.03 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.388 0.613 . . . . 0.0 110.606 178.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.517 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.3 m-80 -101.34 14.38 32.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.654 -178.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -61.31 -41.91 97.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.379 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.835 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 35.5 t70 -94.96 140.27 30.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.558 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -42.05 97.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.183 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.35 -33.55 73.26 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.862 0.363 . . . . 0.0 110.38 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.835 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -59.9 -36.77 77.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.772 177.415 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.34 -23.28 66.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.933 0.396 . . . . 0.0 110.981 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -98.5 -7.02 56.23 Favored Glycine 0 C--N 1.329 0.189 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.496 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.446 HD21 ' HB3' ' A' ' 78' ' ' LEU . 2.6 tt -82.3 -31.25 30.07 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.009 0.433 . . . . 0.0 110.43 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.487 HD21 HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -75.83 -16.23 60.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.881 179.003 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.59 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -113.81 77.99 0.25 Allowed Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 120.957 -0.64 . . . . 0.0 112.225 -176.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.95 54.06 1.51 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.243 0.544 . . . . 0.0 110.412 177.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.01 -117.74 1.04 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 -177.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.9 mt -117.6 49.14 1.25 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.252 0.549 . . . . 0.0 109.778 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.59 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 1.0 OUTLIER -82.72 175.84 9.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.275 -171.362 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.551 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 6.2 t-20 -135.86 -178.79 5.29 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.299 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -111.79 -132.12 5.87 Favored Glycine 0 C--N 1.315 -0.606 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 -177.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.417 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.1 OUTLIER -66.42 149.8 49.86 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 175.684 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.4 m -65.43 89.72 0.1 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.139 0.495 . . . . 0.0 110.957 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.1 -37.24 3.85 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.604 178.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -89.69 98.62 11.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.912 0.387 . . . . 0.0 111.332 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.69 72.16 2.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.152 179.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -169.76 -51.37 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 111.188 -0.765 . . . . 0.0 111.188 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.02 77.73 6.7 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.043 0.449 . . . . 0.0 110.533 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.51 142.45 40.88 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.772 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 4.6 m -123.11 148.41 45.7 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.374 -0.531 . . . . 0.0 111.081 -174.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 1.021 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -107.59 139.26 42.4 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.27 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.782 ' HE3' HD22 ' A' ' 72' ' ' LEU . 0.0 OUTLIER -94.3 167.38 11.57 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.402 179.763 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.73 -30.69 69.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.058 0.456 . . . . 0.0 110.083 176.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -27.02 68.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.885 176.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.782 HD22 ' HE3' ' A' ' 69' ' ' LYS . 1.1 tp -91.14 -24.9 19.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.893 0.378 . . . . 0.0 110.733 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 76.2 mt -72.75 -29.17 29.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 172.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.11 -12.82 59.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.006 172.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.604 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 1.1 tp-100 -93.97 -45.31 7.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.342 -178.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.0 mp -120.28 -41.94 2.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.688 -174.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.61 50.03 3.25 Favored Glycine 0 CA--C 1.515 0.087 0 C-N-CA 120.105 -1.045 . . . . 0.0 112.13 -178.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.472 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -81.56 164.19 22.1 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.699 0.285 . . . . 0.0 111.64 -175.519 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.56 -0.83 9.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.977 -177.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.56 -35.46 68.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -173.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 1.021 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -116.67 27.07 9.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.761 0.315 . . . . 0.0 111.118 -176.734 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.534 HG11 ' HB3' ' A' ' 89' ' ' PRO . 2.0 t -119.21 137.12 54.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.466 178.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.912 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 2.6 t70 -124.13 177.4 5.83 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.987 0.422 . . . . 0.0 111.602 -176.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -56.82 133.4 54.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.853 -175.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.526 HG21 ' HA ' ' A' ' 89' ' ' PRO . 5.7 t -159.32 150.28 19.78 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.106 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -108.53 -19.57 13.4 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.951 0.405 . . . . 0.0 110.474 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -90.36 -46.44 8.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.463 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.441 ' O ' HG13 ' A' ' 90' ' ' VAL . . . 174.14 149.3 6.97 Favored Glycine 0 N--CA 1.444 -0.798 0 N-CA-C 111.219 -0.752 . . . . 0.0 111.219 -177.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.534 ' HB3' HG11 ' A' ' 82' ' ' VAL . 88.8 Cg_exo -45.61 126.85 9.17 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 123.812 3.008 . . . . 0.0 113.393 -173.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.641 HG11 ' HB3' ' A' ' 116' ' ' LYS . 8.7 m -127.43 -179.81 3.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.409 -176.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.76 135.06 52.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.069 -177.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.912 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.5 tttp -85.77 -28.28 24.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.489 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.412 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -148.21 -92.2 0.08 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -169.696 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.844 ' HB ' ' HB2' ' A' ' 35' ' ' CYS . 8.7 mt -101.16 117.15 46.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.091 -168.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.5 t -73.95 125.99 33.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.231 -0.44 . . . . 0.0 109.971 176.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -154.54 176.6 12.19 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.001 -176.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 53.6 m -128.13 127.57 43.27 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.218 177.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.773 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 19.2 m -120.72 137.37 26.3 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.394 -174.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -86.33 155.16 9.41 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 122.428 2.086 . . . . 0.0 111.475 170.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.69 156.04 17.55 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 173.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 97.49 -71.55 0.7 Allowed Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.368 -178.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -150.55 172.03 16.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.511 0.196 . . . . 0.0 111.528 -176.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.482 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.2 OUTLIER 74.48 168.04 0.29 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.644 0.778 . . . . 0.0 113.052 172.076 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.551 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.4 OUTLIER -95.35 178.37 5.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.79 -1.095 . . . . 0.0 112.145 -170.239 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 4.4 m -112.89 142.65 45.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.875 -176.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -90.76 148.99 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 174.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -107.04 140.98 38.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.595 0.236 . . . . 0.0 111.098 -176.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -129.81 20.45 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.826 0.346 . . . . 0.0 111.266 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.89 -54.09 12.73 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 176.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 64.66 -79.56 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.352 179.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -166.84 54.38 0.08 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.555 -179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -172.95 84.0 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.452 -0.88 . . . . 0.0 112.905 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -147.11 90.03 1.85 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.867 0.365 . . . . 0.0 110.482 178.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -76.42 -69.19 1.42 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.269 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -166.48 -45.02 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.806 0.336 . . . . 0.0 110.785 177.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.641 ' HB3' HG11 ' A' ' 90' ' ' VAL . 1.7 pttm -177.89 -32.49 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.109 -176.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -94.16 84.55 4.47 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.775 177.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 . . . . . 0 C--O 1.251 1.152 0 CA-C-O 118.539 -0.744 . . . . 0.0 110.553 -175.721 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.476 0.855 0 CA-C-O 120.566 0.222 . . . . 0.0 110.631 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.498 HD13 ' HD2' ' A' ' 3' ' ' PRO . 0.6 OUTLIER -59.05 126.87 82.75 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.992 -178.499 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.498 ' HD2' HD13 ' A' ' 2' ' ' LEU . 20.9 Cg_exo -66.71 -11.85 33.56 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 123.119 2.546 . . . . 0.0 112.632 177.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 54.99 38.3 30.29 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.051 176.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -147.45 -90.89 0.09 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.248 177.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -137.31 110.03 7.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.241 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -108.28 -3.54 18.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.954 0.407 . . . . 0.0 111.055 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -155.05 110.48 3.08 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.396 0.617 . . . . 0.0 111.373 -177.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -108.22 170.88 7.73 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.259 -0.882 . . . . 0.0 108.932 171.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.71 69.9 0.67 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.441 0.638 . . . . 0.0 111.569 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.5 mmtt -138.01 155.04 49.24 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 176.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.532 ' HB2' ' OG ' ' A' ' 15' ' ' SER . 5.0 mp -76.55 60.99 1.71 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.589 0.233 . . . . 0.0 110.564 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.53 38.73 30.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.249 -179.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 58.76 50.14 9.14 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.68 -174.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.558 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 0.5 OUTLIER -51.99 -52.54 49.84 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.597 -176.408 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.3 -56.64 0.44 Allowed 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.575 0.75 . . . . 0.0 111.599 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.9 -35.71 81.39 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.017 0.437 . . . . 0.0 110.919 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -68.87 -25.12 64.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.479 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.51 -24.24 60.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.458 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -67.98 -29.8 68.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 176.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.542 ' OE1' ' HA ' ' A' ' 116' ' ' LYS . 0.0 OUTLIER -75.29 -27.66 59.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.406 -1.27 . . . . 0.0 110.519 177.274 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.12 -18.83 62.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.682 -176.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.06 -8.11 13.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.029 0.442 . . . . 0.0 110.563 175.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -83.44 -24.94 49.22 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.496 -0.859 . . . . 0.0 111.116 175.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.38 135.01 48.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -74.73 96.91 3.12 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.017 0.437 . . . . 0.0 111.592 -176.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 60.9 m -145.47 136.05 24.27 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 175.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -69.14 144.41 53.86 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.471 -0.196 . . . . 0.0 110.471 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.4 HG23 ' H ' ' A' ' 29' ' ' VAL . 1.6 t -62.95 -36.67 76.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.691 0.282 . . . . 0.0 111.255 -178.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.54 -7.98 88.0 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.999 -0.619 . . . . 0.0 112.289 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.21 38.72 3.13 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.948 0.404 . . . . 0.0 110.133 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.5 tt -99.06 134.43 38.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.523 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -147.97 171.54 15.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.127 0.489 . . . . 0.0 111.585 -172.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.466 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 2.0 t -120.28 145.65 46.87 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.076 172.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -128.68 157.61 40.87 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -176.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.47 ' HB2' ' CD1' ' A' ' 81' ' ' LEU . 10.6 t-20 -151.26 160.42 43.82 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 -177.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.52 146.79 23.01 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.011 176.103 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.604 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 10.7 Cg_endo -54.08 -38.13 87.09 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.154 2.569 . . . . 0.0 112.976 -176.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.5 -13.97 62.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.966 0.413 . . . . 0.0 111.717 -175.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -103.39 -50.11 3.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.638 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 22.7 m -59.76 -36.83 77.46 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.795 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.604 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.9 m-80 -104.8 16.93 25.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.029 -176.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -56.03 -27.68 54.2 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.725 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.993 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 12.2 t70 -116.17 133.28 56.19 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 172.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 17.2 m -66.88 -21.21 66.01 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -176.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.1 tp -91.09 -25.3 19.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.245 0.545 . . . . 0.0 110.12 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.993 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 3.1 tp -61.57 -37.63 84.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.47 -177.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.623 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -64.64 -20.14 66.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.91 -177.084 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -95.96 -9.73 56.95 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.045 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.587 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 2.0 mp -85.82 -26.07 25.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.825 0.345 . . . . 0.0 111.154 -177.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.623 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.3 OUTLIER -80.03 -11.11 59.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.939 0.4 . . . . 0.0 111.744 -175.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.637 ' HA3' ' CB ' ' A' ' 56' ' ' LEU . . . -128.05 91.28 0.34 Allowed Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.808 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.412 ' H ' HD21 ' A' ' 72' ' ' LEU . . . -77.91 74.68 4.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.258 0.551 . . . . 0.0 110.648 -178.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 159.49 -69.53 0.25 Allowed Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.136 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.2 tp -136.54 -40.72 0.63 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.637 ' CB ' ' HA3' ' A' ' 52' ' ' GLY . 0.1 OUTLIER 69.13 134.34 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 122.435 1.112 . . . . 0.0 112.672 178.603 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.565 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 8.8 t-20 -141.44 -178.8 5.79 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 114.202 -1.363 . . . . 0.0 107.9 171.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.692 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -114.97 -145.44 8.71 Favored Glycine 0 C--N 1.312 -0.768 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.62 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.468 ' HB3' ' HB2' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -65.2 156.28 32.33 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.469 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.7 m -52.28 101.94 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.099 0.476 . . . . 0.0 111.726 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 74.67 18.63 80.04 Favored Glycine 0 C--N 1.338 0.663 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.529 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.468 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 4.1 t30 -123.29 94.52 4.28 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.866 0.365 . . . . 0.0 110.795 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.06 99.67 7.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.065 0.459 . . . . 0.0 111.051 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 155.7 -55.37 0.41 Allowed Glycine 0 CA--C 1.508 -0.348 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 177.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.78 84.15 6.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.954 0.407 . . . . 0.0 109.999 175.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.692 ' HA ' ' HA2' ' A' ' 58' ' ' GLY . . . -90.54 150.81 21.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.936 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 m -124.26 136.34 54.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.972 0.415 . . . . 0.0 111.195 -174.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -105.63 139.23 40.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.95 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -95.54 168.24 10.81 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.732 -173.885 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.49 -33.32 73.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.047 0.451 . . . . 0.0 111.026 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -31.01 71.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.331 0.586 . . . . 0.0 110.173 177.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.458 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.0 OUTLIER -79.73 -21.65 44.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.686 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.94 -41.5 89.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.368 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -90.22 -0.44 57.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.461 . . . . 0.0 110.746 179.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.79 -52.95 4.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.535 178.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.587 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 1.1 mm? -118.67 -46.22 2.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.131 -177.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 101.97 52.54 1.01 Allowed Glycine 0 CA--C 1.519 0.315 0 C-N-CA 119.724 -1.227 . . . . 0.0 113.388 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.491 ' HG ' ' HB3' ' A' ' 51' ' ' LEU . 3.9 mm? -64.48 92.34 0.09 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.989 0.424 . . . . 0.0 111.736 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.8 -11.65 60.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.686 -178.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.24 -15.46 46.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.174 0.511 . . . . 0.0 110.621 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.47 ' CD1' ' HB2' ' A' ' 36' ' ' ASN . 0.0 OUTLIER -108.37 -16.35 14.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.622 -176.258 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.33 137.85 46.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.187 0.518 . . . . 0.0 110.976 -178.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.636 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 3.2 t70 -113.85 176.91 4.83 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 176.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -135.19 124.7 24.99 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -171.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.526 HG21 ' HD3' ' A' ' 116' ' ' LYS . 0.6 OUTLIER -117.15 -169.34 1.63 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.988 -1.006 . . . . 0.0 108.962 171.578 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.02 -29.15 61.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.849 0.357 . . . . 0.0 110.778 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.558 ' HB3' ' O ' ' A' ' 15' ' ' SER . 35.3 mp0 -76.6 -14.52 59.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.621 -178.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 135.51 -165.52 24.73 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 119.964 -1.113 . . . . 0.0 112.728 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -74.49 125.6 9.71 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.88 2.386 . . . . 0.0 111.802 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.521 HG11 ' HB3' ' A' ' 116' ' ' LYS . 0.7 OUTLIER -124.15 -177.96 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.079 -176.699 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.62 ' O ' ' HA ' ' A' ' 115' ' ' THR . 0.1 OUTLIER -70.28 129.93 40.65 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 178.495 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.636 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 11.8 tttp -79.74 -27.69 40.54 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.639 -176.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -155.02 -90.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -172.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.415 HD12 ' HA ' ' A' ' 36' ' ' ASN . 5.2 mt -95.63 138.66 20.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.002 -171.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.6 t -101.67 123.09 54.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.586 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.15 157.92 43.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.909 -177.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.36 124.26 49.25 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 177.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.442 ' CA ' ' HB3' ' A' ' 105' ' ' CYS . 8.3 t -135.45 133.03 20.12 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.188 -171.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.409 ' O ' ' HD2' ' A' ' 69' ' ' LYS . 36.9 Cg_endo -65.84 171.77 9.35 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.755 2.304 . . . . 0.0 111.683 174.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.63 -82.49 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -171.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -128.02 0.76 6.67 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.064 -1.065 . . . . 0.0 113.413 -174.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.03 142.32 51.57 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.682 0.241 . . . . 0.0 111.511 -175.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 6.3 m 73.59 157.32 0.19 Allowed 'General case' 0 CA--C 1.532 0.286 0 O-C-N 123.882 0.739 . . . . 0.0 112.304 175.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.565 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.7 OUTLIER -73.11 168.9 18.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.762 -175.374 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.442 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -113.22 141.82 46.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.027 -179.403 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -83.3 145.99 7.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.065 174.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.94 115.69 23.02 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.458 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -85.89 -8.63 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-O 121.837 0.827 . . . . 0.0 110.071 177.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -117.79 135.9 53.76 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 114.315 -1.311 . . . . 0.0 108.512 176.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -121.12 61.9 0.9 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.177 0.513 . . . . 0.0 109.877 -177.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 67.31 47.57 1.28 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.171 178.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -139.36 10.8 3.25 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.626 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -94.82 -154.91 0.44 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 122.758 -0.26 . . . . 0.0 110.836 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -158.56 -174.72 28.64 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 121.201 -0.523 . . . . 0.0 112.003 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.62 ' HA ' ' O ' ' A' ' 91' ' ' CYS . 0.0 OUTLIER -59.52 -63.53 1.27 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.167 0.508 . . . . 0.0 111.026 -178.709 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.542 ' HA ' ' OE1' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -152.7 146.9 25.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.343 178.691 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -80.44 127.58 32.58 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.7 177.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 C--O 1.248 1.019 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.855 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.477 0.913 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -102.23 115.21 64.9 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.554 179.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -68.81 156.71 64.56 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.996 2.464 . . . . 0.0 112.416 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 74.36 -20.19 0.33 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.588 0.755 . . . . 0.0 112.176 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.31 20.15 3.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.838 -0.164 . . . . 0.0 111.117 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 53.54 79.09 0.13 Allowed 'General case' 0 C--O 1.234 0.277 0 O-C-N 123.581 0.55 . . . . 0.0 111.64 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.91 73.22 7.45 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.096 -177.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.3 94.15 7.29 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.952 177.258 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -85.22 -30.29 23.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.718 -175.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.05 164.94 21.05 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.2 0.524 . . . . 0.0 112.103 -172.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.6 mttp -130.8 -69.66 0.64 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.523 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.96 -39.79 0.42 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.772 0.829 . . . . 0.0 111.612 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.3 -34.86 78.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.709 0.29 . . . . 0.0 111.39 179.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.71 -20.15 47.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.81 0.338 . . . . 0.0 111.641 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.684 ' HA ' ' O ' ' A' ' 87' ' ' GLU . 0.3 OUTLIER -76.19 68.15 2.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.211 0.529 . . . . 0.0 111.317 179.295 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.75 -19.9 66.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.851 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.5 ' HB1' ' HB3' ' A' ' 116' ' ' LYS . . . -82.04 -26.89 33.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.503 177.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.553 ' O ' ' HB2' ' A' ' 21' ' ' GLN . 41.2 t80 -82.73 -41.55 19.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.758 -178.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.76 -18.91 61.66 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.7 mttp -67.33 -18.01 64.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.014 0.435 . . . . 0.0 110.533 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.553 ' HB2' ' O ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -63.69 -28.1 69.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.562 177.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.05 -18.56 62.56 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.406 -178.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -98.35 -41.53 7.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.487 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -66.41 -30.33 76.39 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.679 177.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.601 HG21 HG21 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -133.62 123.02 24.32 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 176.241 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.79 97.64 1.82 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.02 0.438 . . . . 0.0 111.464 -176.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.465 ' HB2' HD12 ' A' ' 32' ' ' ILE . 79.8 m -139.51 -178.43 5.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.653 179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.701 ' H ' ' HB2' ' A' ' 31' ' ' SER . 30.0 t-20 -122.03 176.61 5.71 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 -176.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.43 HG23 ' H ' ' A' ' 30' ' ' GLY . 2.5 m -52.76 -53.49 20.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -178.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.43 ' H ' HG23 ' A' ' 29' ' ' VAL . . . -89.41 20.62 33.21 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.961 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.701 ' HB2' ' H ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -123.61 -12.2 7.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.849 0.357 . . . . 0.0 110.839 177.044 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.465 HD12 ' HB2' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -82.22 127.26 39.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 175.684 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.72 153.99 38.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.152 0.501 . . . . 0.0 111.462 -174.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.433 ' O ' HD13 ' A' ' 81' ' ' LEU . 11.5 t -122.7 143.06 50.04 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.628 176.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -127.54 163.83 23.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.605 0.716 . . . . 0.0 110.985 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.462 ' HB2' ' HA ' ' A' ' 81' ' ' LEU . 20.2 t-20 -136.14 160.82 37.51 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.19 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -45.8 137.07 5.99 Favored Pre-proline 0 C--N 1.329 -0.292 0 O-C-N 123.588 0.555 . . . . 0.0 110.457 177.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.496 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 79.7 Cg_exo -48.54 -36.84 32.58 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 123.254 2.636 . . . . 0.0 113.351 -175.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.02 -7.82 50.99 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -177.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.4 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 0.9 OUTLIER -109.18 -41.78 4.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.127 0.489 . . . . 0.0 109.86 178.551 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.437 HG21 ' HB3' ' A' ' 66' ' ' ALA . 29.0 m -65.45 -37.05 85.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.671 175.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.496 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.3 m-80 -100.27 15.31 28.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.707 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.4 ' HB2' ' HA ' ' A' ' 40' ' ' GLU . 10.1 t-20 -65.11 -32.75 74.61 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.474 -176.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.931 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.6 t70 -104.8 146.6 28.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.636 178.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.86 -36.94 75.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.002 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.3 tp -86.47 -20.89 27.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.134 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.931 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -53.73 -47.54 70.49 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.109 0.481 . . . . 0.0 111.203 179.047 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.59 -18.24 65.26 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.22 -178.304 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -93.98 -29.13 10.04 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.737 176.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.457 HD22 ' HG ' ' A' ' 76' ' ' LEU . 27.9 mt -74.11 -24.53 59.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 176.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.444 ' HA ' HD13 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -55.67 -51.8 66.02 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.691 173.219 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -87.02 74.23 2.35 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.842 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -100.9 32.92 2.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.593 0.711 . . . . 0.0 109.334 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 160.73 -111.88 0.5 Allowed Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.51 -174.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.567 HD12 ' HA2' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -117.15 72.33 0.83 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.364 0.602 . . . . 0.0 110.392 176.896 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.66 ' HG ' ' HZ2' ' A' ' 69' ' ' LYS . 1.5 mp -123.44 134.1 53.98 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.253 178.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -128.42 -177.34 4.13 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.297 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.72 -162.83 35.06 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.617 -0.802 . . . . 0.0 113.073 -173.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.402 HD23 ' HB2' ' A' ' 65' ' ' SER . 0.4 OUTLIER -65.35 158.2 27.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.508 0.194 . . . . 0.0 110.494 -179.679 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.968 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -61.07 88.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.464 0.65 . . . . 0.0 112.283 -177.638 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.03 4.1 78.76 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.454 -0.794 . . . . 0.0 113.11 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.4 t30 -117.66 134.6 54.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 117.123 0.461 . . . . 0.0 111.422 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.0 125.99 47.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.407 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.11 -49.37 0.93 Allowed Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.856 -0.687 . . . . 0.0 111.752 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.402 ' HB2' HD23 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -82.56 115.5 21.57 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 175.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.437 ' HB3' HG21 ' A' ' 41' ' ' THR . . . -127.77 147.34 50.41 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.265 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.9 m -121.08 135.63 55.15 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.909 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.806 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -105.82 152.45 23.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 176.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.66 ' HZ2' ' HG ' ' A' ' 56' ' ' LEU . 0.0 OUTLIER -111.62 -177.2 3.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.385 -176.956 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.3 -24.5 67.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.073 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -66.77 -31.02 71.38 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.417 0.627 . . . . 0.0 110.027 178.773 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.481 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -90.43 -33.72 15.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.709 179.632 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.1 mt -65.87 -39.45 84.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.597 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -84.48 -2.97 58.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.899 0.381 . . . . 0.0 110.841 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -94.75 -53.31 3.91 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.052 0.453 . . . . 0.0 110.823 178.38 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.468 ' HA ' HD13 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -126.28 -28.57 3.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.804 -175.339 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.04 50.69 4.49 Favored Glycine 0 C--O 1.228 -0.274 0 C-N-CA 120.343 -0.932 . . . . 0.0 111.929 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.6 mt -59.19 96.15 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.766 0.426 . . . . 0.0 111.944 -176.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.435 ' HG ' ' H ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -79.17 6.26 10.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.414 -177.15 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.97 -26.47 64.11 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.255 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.806 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -129.9 2.1 4.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.714 -176.292 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 39.0 t -111.69 138.25 41.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.12 0.486 . . . . 0.0 110.97 -175.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 3.3 t70 -123.87 177.31 5.81 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.427 176.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -136.2 137.74 41.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.048 0.451 . . . . 0.0 112.202 -172.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -135.56 -169.3 2.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.669 174.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -42.93 99.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.145 0.497 . . . . 0.0 109.968 177.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.684 ' O ' ' HA ' ' A' ' 15' ' ' SER . 3.1 mp0 -81.57 43.29 0.74 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.47 -179.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 80.89 -170.37 52.97 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.974 -0.557 . . . . 0.0 113.52 173.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.452 ' O ' ' HB3' ' A' ' 15' ' ' SER . 11.0 Cg_exo -70.84 134.5 25.84 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 123.072 2.514 . . . . 0.0 111.369 174.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.46 ' HB ' ' H ' ' A' ' 91' ' ' CYS . 0.6 OUTLIER -132.81 -153.6 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.66 -174.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.587 ' HB3' ' O ' ' A' ' 114' ' ' GLY . 0.5 OUTLIER -94.45 152.87 18.26 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.428 -178.036 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.433 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 1.1 tttt -92.92 -34.82 13.63 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.29 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -159.12 -62.4 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.416 HG23 ' HB3' ' A' ' 109' ' ' ASP . 33.3 mt -112.27 132.6 60.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.905 0.383 . . . . 0.0 111.809 -171.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.459 HG22 HG23 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -105.16 139.02 27.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.489 175.824 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.417 ' CB ' ' HA ' ' A' ' 107' ' ' ALA . . . -149.94 167.57 26.29 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 121.22 0.534 . . . . 0.0 111.859 -176.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 4.2 t -112.46 114.71 27.54 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.103 176.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.632 ' O ' ' HA ' ' A' ' 31' ' ' SER . 46.8 t -135.05 106.72 10.39 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.799 -174.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.665 ' HD2' HG21 ' A' ' 102' ' ' THR . 25.9 Cg_exo -67.54 144.83 68.34 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.958 2.439 . . . . 0.0 112.251 173.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.32 72.03 3.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.494 0.664 . . . . 0.0 109.802 171.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.567 ' HA2' HD12 ' A' ' 55' ' ' LEU . . . 145.11 63.46 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.313 -177.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.665 HG21 ' HD2' ' A' ' 99' ' ' PRO . 12.0 t -148.29 156.69 42.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.943 0.401 . . . . 0.0 111.061 -176.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -38.54 87.18 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.521 177.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.968 ' HB2' ' HA ' ' A' ' 60' ' ' SER . 0.2 OUTLIER -155.14 159.49 40.22 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.735 176.589 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.461 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 1.8 m -111.63 140.39 46.28 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 176.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -96.74 136.81 26.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.235 0.541 . . . . 0.0 111.477 -175.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.417 ' HA ' ' CB ' ' A' ' 96' ' ' ALA . . . -90.83 130.04 36.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.924 176.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.601 HG21 HG21 ' A' ' 25' ' ' THR . 0.0 OUTLIER -95.22 -6.26 10.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.423 0.63 . . . . 0.0 111.013 -179.004 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.416 ' HB3' HG23 ' A' ' 94' ' ' ILE . 2.7 t70 -72.65 129.06 37.38 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.389 175.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -132.09 17.86 4.56 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.669 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -144.01 -27.18 0.53 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -176.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 98.63 45.72 2.25 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.156 -175.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -143.44 120.02 11.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.807 0.337 . . . . 0.0 110.62 -177.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . 0.587 ' O ' ' HB3' ' A' ' 91' ' ' CYS . . . -177.93 66.82 0.08 OUTLIER Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.53 -0.843 . . . . 0.0 112.444 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.58 -60.12 2.48 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.622 0.725 . . . . 0.0 109.575 174.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.5 ' HB3' ' HB1' ' A' ' 17' ' ' ALA . 13.7 mtmt -128.8 -120.99 0.23 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 174.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -120.92 135.71 55.13 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 171.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 . . . . . 0 C--O 1.252 1.211 0 CA-C-O 118.598 -0.715 . . . . 0.0 109.714 178.015 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.612 HD13 ' HD2' ' A' ' 3' ' ' PRO . 0.8 OUTLIER -56.62 135.5 77.73 Favored Pre-proline 0 CA--C 1.533 0.294 0 O-C-N 123.342 0.401 . . . . 0.0 111.051 178.185 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.612 ' HD2' HD13 ' A' ' 2' ' ' LEU . 32.3 Cg_exo -59.77 99.48 0.13 Allowed 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 123.174 2.582 . . . . 0.0 112.921 -179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -162.7 157.21 21.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.332 177.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.22 -1.79 34.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.187 0.517 . . . . 0.0 110.798 179.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -100.39 40.33 1.27 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.191 -177.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -87.52 59.57 5.55 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.16 0.505 . . . . 0.0 110.496 178.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.0 mtpt -129.52 4.34 5.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.132 -177.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.3 p-10 -127.62 24.31 6.18 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.239 0.542 . . . . 0.0 110.501 -179.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -90.09 143.04 27.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.519 -178.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.7 mmtt -95.6 157.24 15.98 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.34 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.445 ' HB2' ' HB3' ' A' ' 15' ' ' SER . 5.2 mp -79.21 61.34 3.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.983 -177.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 36.82 74.05 0.08 Allowed 'General case' 0 N--CA 1.472 0.636 0 O-C-N 124.144 0.903 . . . . 0.0 112.986 175.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.27 62.71 1.14 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.602 0.715 . . . . 0.0 111.083 -177.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.445 ' HB3' ' HB2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -85.25 49.69 1.8 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.135 -177.316 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.413 ' HB3' ' OE1' ' A' ' 87' ' ' GLU . . . -67.67 -51.44 49.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.907 ' HB1' ' HE3' ' A' ' 116' ' ' LYS . . . -59.49 -33.08 70.89 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.479 176.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.606 ' HB2' HG12 ' A' ' 90' ' ' VAL . 23.7 t80 -70.25 -47.1 62.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.056 0.455 . . . . 0.0 110.335 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.8 -23.98 64.35 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.915 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -67.9 -25.08 65.31 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.847 0.832 . . . . 0.0 109.254 177.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.11 -38.16 11.75 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.409 -1.268 . . . . 0.0 110.601 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.73 -17.81 64.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.97 -176.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.62 -8.02 57.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.939 0.399 . . . . 0.0 110.677 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.31 1.72 37.45 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.802 -0.714 . . . . 0.0 111.44 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.433 HG21 ' HB ' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -114.65 124.55 52.12 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.297 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.43 94.59 2.1 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.08 0.467 . . . . 0.0 111.06 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 27.7 m -151.85 -177.53 6.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.036 179.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -112.7 151.32 30.36 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 176.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.9 t -58.29 -40.89 79.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.917 0.389 . . . . 0.0 111.066 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.51 8.33 54.58 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.486 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -143.58 32.46 1.3 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.944 0.402 . . . . 0.0 110.312 178.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.9 134.86 31.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.503 ' CB ' ' HB3' ' A' ' 98' ' ' CYS . . . -149.2 170.88 17.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.254 0.549 . . . . 0.0 111.974 -175.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.2 t -118.26 141.87 48.07 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.829 173.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -126.17 156.29 40.39 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.398 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.456 ' HA ' HD12 ' A' ' 94' ' ' ILE . 56.0 t30 -156.2 160.37 39.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.172 178.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.597 ' HB2' ' OE1' ' A' ' 40' ' ' GLU . 1.5 m -59.61 148.45 74.64 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.069 -177.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.63 ' HA ' HG22 ' A' ' 41' ' ' THR . 32.4 Cg_endo -65.79 -26.72 52.37 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.031 2.488 . . . . 0.0 113.424 -175.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.23 -11.92 58.71 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.142 0.496 . . . . 0.0 111.312 -176.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.597 ' OE1' ' HB2' ' A' ' 37' ' ' SER . 1.9 mp0 -108.17 -51.03 2.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.229 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.63 HG22 ' HA ' ' A' ' 38' ' ' PRO . 1.2 t -69.63 -20.56 63.6 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.296 -176.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.582 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.1 m-80 -105.47 3.46 29.55 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 -178.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -71.76 -46.92 56.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.741 0.305 . . . . 0.0 111.386 -176.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 1.046 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 61.1 t0 -75.68 133.6 40.77 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 178.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -23.61 66.94 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.633 178.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.608 ' HG ' HD13 ' A' ' 50' ' ' LEU . 11.3 tp -87.14 -32.6 19.79 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.288 177.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 1.046 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -64.52 -34.22 77.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.145 -177.185 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -18.12 64.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.074 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -102.73 -30.44 5.52 Favored Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 111.374 -0.69 . . . . 0.0 111.374 173.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.67 ' HG ' ' HB3' ' A' ' 76' ' ' LEU . 1.9 mp -60.28 -36.45 77.85 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 122.667 0.387 . . . . 0.0 110.992 178.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.8 pp -73.4 -11.25 60.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.005 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.61 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -111.99 66.31 0.24 Allowed Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.227 -178.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.442 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -78.87 66.7 4.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.907 0.384 . . . . 0.0 111.4 -178.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 90.43 82.92 1.38 Allowed Glycine 0 C--O 1.226 -0.356 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.04 176.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.5 tp 63.27 20.57 12.35 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.857 0.463 . . . . 0.0 112.029 176.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.789 HD22 ' HA2' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -53.87 145.84 15.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.816 178.089 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -113.24 -178.23 3.33 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.452 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -109.03 -158.28 18.61 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.073 -176.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.74 HD23 ' HB3' ' A' ' 62' ' ' ASN . 1.2 tp -77.5 138.42 39.2 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 120.737 0.303 . . . . 0.0 110.216 178.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 50.6 m -53.34 108.05 0.3 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.444 -175.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.11 -12.87 64.9 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.549 173.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.74 ' HB3' HD23 ' A' ' 59' ' ' LEU . 18.8 t30 -127.92 114.57 17.34 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.321 0.581 . . . . 0.0 110.954 -178.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.11 160.08 30.11 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.919 -178.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.419 ' C ' ' HB3' ' A' ' 38' ' ' PRO . . . 94.92 -42.45 2.39 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.617 178.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.446 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 0.7 OUTLIER -81.98 117.62 22.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.874 0.369 . . . . 0.0 110.48 -178.761 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.16 143.86 34.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.08 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.68 128.69 55.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.028 0.442 . . . . 0.0 110.858 -178.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.529 ' HB2' HD12 ' A' ' 81' ' ' LEU . . . -112.78 129.83 56.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.95 -177.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.774 ' HZ1' HD11 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -95.94 173.27 7.53 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.539 -178.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.444 ' HA ' HD13 ' A' ' 73' ' ' ILE . . . -58.24 -29.94 66.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.911 0.386 . . . . 0.0 111.207 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -28.3 68.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.096 178.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.657 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 2.0 mp -86.37 -17.71 33.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.061 0.458 . . . . 0.0 110.586 -179.031 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.453 HG13 HG21 ' A' ' 82' ' ' VAL . 0.5 OUTLIER -63.59 -41.53 92.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.969 177.901 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -89.52 -12.83 38.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.271 0.558 . . . . 0.0 110.564 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.657 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.5 OUTLIER -77.04 -53.53 7.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.222 -178.344 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.67 ' HB3' ' HG ' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -125.5 -29.99 3.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.312 -175.824 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.31 48.69 18.1 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 120.302 -0.951 . . . . 0.0 111.999 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.412 ' H ' HD12 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -74.95 97.29 3.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.833 0.349 . . . . 0.0 111.129 -177.716 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.34 8.46 2.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.366 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.28 -27.28 47.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.019 0.438 . . . . 0.0 109.935 174.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.529 HD12 ' HB2' ' A' ' 68' ' ' ALA . 7.9 mt -117.83 -5.62 11.06 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.597 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.453 HG21 HG13 ' A' ' 73' ' ' ILE . 11.6 t -117.46 138.0 49.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.481 178.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -132.49 178.06 7.12 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.079 178.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -136.03 98.89 3.99 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.842 0.353 . . . . 0.0 111.205 -174.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.5 t -82.3 -173.6 4.65 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.866 175.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -78.72 55.36 1.67 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.076 0.465 . . . . 0.0 110.808 -178.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.413 ' OE1' ' HB3' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -161.11 -59.88 0.05 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.854 -178.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -171.82 -174.48 39.39 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.811 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.09 121.3 7.92 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.755 2.303 . . . . 0.0 110.76 174.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.606 HG12 ' HB2' ' A' ' 18' ' ' PHE . 2.7 m -136.28 -174.31 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.211 0.529 . . . . 0.0 111.619 -170.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.49 130.62 43.62 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.902 177.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.1 tttt -71.91 -43.91 64.56 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.012 0.434 . . . . 0.0 110.311 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -149.56 -100.92 0.07 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.257 -173.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.456 HD12 ' HA ' ' A' ' 36' ' ' ASN . 6.7 mt -73.61 126.88 35.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.765 -169.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.433 ' HB ' HG21 ' A' ' 25' ' ' THR . 0.1 OUTLIER -89.57 133.14 32.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.242 177.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.463 ' HB1' ' O ' ' A' ' 106' ' ' VAL . . . -153.5 167.53 29.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.139 0.495 . . . . 0.0 111.83 -175.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -109.26 132.75 53.82 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 174.741 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.517 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 44.0 t -152.45 135.0 8.99 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-O 120.81 0.338 . . . . 0.0 111.636 -171.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.413 ' O ' ' HD2' ' A' ' 69' ' ' LYS . 75.2 Cg_endo -77.29 -177.84 4.14 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 123.411 2.741 . . . . 0.0 111.019 172.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -76.28 -121.59 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -176.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.789 ' HA2' HD22 ' A' ' 56' ' ' LEU . . . -92.52 51.7 2.69 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 121.074 -0.584 . . . . 0.0 112.983 -176.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.35 137.23 1.08 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 176.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.2 m 72.85 147.69 0.09 Allowed 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.24 0.962 . . . . 0.0 111.653 178.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -73.09 164.11 27.17 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.857 -177.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.517 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.8 OUTLIER -111.12 143.17 42.27 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.696 -179.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.463 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 0.9 OUTLIER -100.69 138.7 24.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.057 0.456 . . . . 0.0 110.435 -177.693 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.98 122.93 41.7 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.935 178.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -98.23 14.2 4.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.265 0.555 . . . . 0.0 111.051 -177.288 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -123.54 120.93 34.31 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.893 174.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -142.79 4.57 1.5 Allowed 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.587 176.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -178.62 23.73 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.665 -175.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -110.28 -12.16 18.22 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.765 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . 68.76 57.87 0.4 Allowed 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.164 0.585 . . . . 0.0 111.45 175.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -72.84 116.44 5.64 Favored Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.744 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 33.1 m -160.1 101.28 1.41 Allowed 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.907 ' HE3' ' HB1' ' A' ' 17' ' ' ALA . 0.0 OUTLIER -98.37 2.2 47.71 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.835 179.624 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . 0.676 ' O ' ' HB2' ' A' ' 118' ' ' GLU . . . -82.64 73.89 9.65 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 172.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.676 ' HB2' ' O ' ' A' ' 117' ' ' ALA . 0.6 OUTLIER . . . . . 0 C--O 1.255 1.346 0 CA-C-N 113.833 -1.53 . . . . 0.0 107.569 -171.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.453 ' HB2' ' H ' ' A' ' 2' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.571 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.482 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 9.9 mt -119.82 133.04 23.86 Favored Pre-proline 0 C--N 1.328 -0.336 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 177.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 2' ' ' LEU . 12.1 Cg_exo -69.9 167.29 25.04 Favored 'Trans proline' 0 C--O 1.234 0.279 0 C-N-CA 123.14 2.56 . . . . 0.0 112.618 -178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.62 -158.25 0.64 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.287 178.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.15 -61.59 1.54 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.92 0.39 . . . . 0.0 110.891 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.67 57.86 3.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.732 -175.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -118.81 81.45 1.7 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.11 178.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -152.11 36.59 0.54 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.747 -175.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -84.35 42.86 0.91 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.325 -177.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -123.68 134.8 53.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.461 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.2 mttm -138.26 -67.55 0.47 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.484 -179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.401 HD22 ' HA ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER 74.89 -52.1 0.67 Allowed 'General case' 0 N--CA 1.469 0.475 0 O-C-N 123.911 0.757 . . . . 0.0 111.799 176.701 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.84 -33.74 76.35 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.091 0.472 . . . . 0.0 111.016 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -4.7 57.45 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.659 -179.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.507 ' HA ' ' HA3' ' A' ' 88' ' ' GLY . 4.1 m -83.26 92.22 7.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.185 -178.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.1 -31.46 67.81 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.33 0.586 . . . . 0.0 109.652 176.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.96 -31.81 72.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.185 176.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.567 ' HD1' ' HA ' ' A' ' 90' ' ' VAL . 22.8 t80 -73.23 -35.0 66.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.246 0.546 . . . . 0.0 109.836 176.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.63 -29.57 68.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.173 0.511 . . . . 0.0 110.463 174.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.1 tttt -66.74 -38.41 86.59 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 174.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.412 ' HG2' HG11 ' A' ' 95' ' ' VAL . 0.8 OUTLIER -61.55 -35.08 76.75 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.849 176.468 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.58 -11.59 60.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.53 -178.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.14 -35.04 6.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.137 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.15 -34.37 89.49 Favored Glycine 0 N--CA 1.451 -0.366 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 175.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.22 129.9 55.76 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 174.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.9 m -68.83 98.23 0.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -170.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 98.7 m -144.65 -178.16 5.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.031 -0.986 . . . . 0.0 108.595 174.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -101.17 150.41 22.97 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.191 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.5 -31.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.783 -177.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.5 -49.41 5.82 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.545 -0.836 . . . . 0.0 111.023 175.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.443 ' HB3' ' HA ' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -87.56 53.69 2.88 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.345 -0.428 . . . . 0.0 110.738 179.034 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.441 HD12 ' HA ' ' A' ' 32' ' ' ILE . 9.0 tp -108.68 139.52 30.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.936 0.398 . . . . 0.0 110.694 -179.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.777 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . . . -150.21 -178.74 6.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.348 0.594 . . . . 0.0 112.003 -177.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 48.8 t -133.16 134.41 44.1 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 171.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.447 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 99.3 m -106.53 145.08 32.3 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.018 0.437 . . . . 0.0 110.232 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.406 HD21 ' HB2' ' A' ' 40' ' ' GLU . 26.8 t30 -139.21 150.87 46.04 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.598 ' HB2' ' OE1' ' A' ' 40' ' ' GLU . 0.3 OUTLIER -42.71 139.08 2.11 Favored Pre-proline 0 CA--C 1.536 0.418 0 O-C-N 123.877 0.736 . . . . 0.0 112.434 179.807 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.461 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 20.3 Cg_endo -59.86 -40.61 61.43 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.561 2.841 . . . . 0.0 114.038 -171.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.76 -19.96 65.17 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.22 0.533 . . . . 0.0 111.661 -174.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.598 ' OE1' ' HB2' ' A' ' 37' ' ' SER . 45.3 mp0 -100.37 -39.83 7.79 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.064 -179.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 47.4 m -64.93 -35.49 81.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.641 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -104.04 15.7 27.94 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.862 -177.748 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -59.69 -25.59 64.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.986 -174.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 1.052 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 15.2 t70 -121.61 135.28 55.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.476 -177.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.77 -35.08 72.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.671 0.272 . . . . 0.0 111.315 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.424 ' HB3' ' OD2' ' A' ' 44' ' ' ASP . 2.6 tp -76.47 -40.52 50.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.99 0.424 . . . . 0.0 110.046 178.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 1.052 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 2.7 tp -56.74 -42.94 80.15 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.935 176.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.481 ' HA ' HD11 ' A' ' 51' ' ' LEU . 15.9 m -64.75 -9.14 18.07 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.176 -0.466 . . . . 0.0 112.213 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -108.95 -5.08 31.18 Favored Glycine 0 C--O 1.228 -0.235 0 N-CA-C 111.214 -0.754 . . . . 0.0 111.214 174.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.728 ' HG ' HD23 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -84.68 -25.81 28.19 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.546 -0.327 . . . . 0.0 111.287 -176.698 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.604 ' HG ' ' HB1' ' A' ' 66' ' ' ALA . 0.0 OUTLIER -77.4 1.23 19.64 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.448 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -146.52 85.81 0.17 Allowed Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.259 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.56 51.71 0.75 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.266 0.555 . . . . 0.0 110.872 178.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 171.11 -99.9 0.15 Allowed Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.42 ' O ' HG22 ' A' ' 102' ' ' THR . 0.7 OUTLIER -149.21 48.03 0.98 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.63 0.729 . . . . 0.0 109.621 176.159 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.691 HD13 ' HE3' ' A' ' 69' ' ' LYS . 0.2 OUTLIER -87.92 -178.89 6.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.139 -176.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.447 ' H ' HD23 ' A' ' 56' ' ' LEU . 1.1 t-20 -140.94 -176.37 4.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.033 -175.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.561 ' HA3' ' HA ' ' A' ' 66' ' ' ALA . . . -113.55 -118.66 3.46 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.289 -175.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.426 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -65.45 140.22 58.59 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.62 0.247 . . . . 0.0 110.338 179.409 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.566 ' HA ' ' CB ' ' A' ' 104' ' ' ASN . 64.2 m -62.85 89.89 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.368 -178.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.67 -36.42 4.26 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.947 -0.644 . . . . 0.0 112.738 177.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -91.08 101.98 14.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.026 0.441 . . . . 0.0 111.214 -176.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.72 93.54 3.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.993 179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 170.58 -54.28 0.19 Allowed Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.279 -0.729 . . . . 0.0 111.279 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.49 106.72 8.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 174.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.604 ' HB1' ' HG ' ' A' ' 51' ' ' LEU . . . -107.09 154.87 20.52 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.58 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 4.9 m -135.46 145.69 47.43 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -177.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 1.025 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -105.23 130.45 53.37 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.126 0.488 . . . . 0.0 110.454 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 1.047 ' HD3' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -84.3 161.78 20.32 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.585 -178.757 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.662 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -56.78 -36.3 69.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.743 0.306 . . . . 0.0 111.638 -178.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -64.86 -31.05 72.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.486 0.66 . . . . 0.0 110.123 178.38 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.506 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -79.67 -33.51 41.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.564 179.255 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.662 HD12 ' HA ' ' A' ' 70' ' ' ALA . 41.0 mt -66.49 -34.49 70.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.558 177.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -73.5 -40.2 64.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.688 175.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.405 ' HB2' ' O ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -76.54 -55.09 5.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -174.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.728 HD23 ' HG ' ' A' ' 50' ' ' LEU . 3.7 mp -109.85 -28.33 8.83 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.915 -0.314 . . . . 0.0 111.133 -173.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.402 ' HA2' ' O ' ' A' ' 73' ' ' ILE . . . 82.61 50.43 4.72 Favored Glycine 0 CA--C 1.516 0.15 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.526 173.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.538 ' HG ' HD23 ' A' ' 50' ' ' LEU . 4.7 mp -68.04 108.3 3.03 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.108 0.48 . . . . 0.0 111.546 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.511 ' HG ' ' H ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -90.69 12.06 20.24 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.887 178.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.04 -26.46 60.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.51 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 1.025 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -119.42 9.75 11.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.52 -175.627 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.4 t -104.62 136.56 37.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.757 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 28.3 t0 -117.13 168.99 9.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.072 0.463 . . . . 0.0 111.746 -176.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -56.96 147.47 23.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.405 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.455 HG21 ' C ' ' A' ' 88' ' ' GLY . 9.5 t -153.96 155.72 36.13 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.118 0.485 . . . . 0.0 111.752 -175.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.13 -0.55 15.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.554 0.692 . . . . 0.0 109.44 174.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.439 ' HB3' ' H ' ' A' ' 88' ' ' GLY . 7.6 tm-20 -115.0 -86.33 0.6 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.389 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.507 ' HA3' ' HA ' ' A' ' 15' ' ' SER . . . -141.89 155.04 25.23 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 172.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.407 ' N ' HG21 ' A' ' 85' ' ' THR . 82.2 Cg_exo -45.32 119.53 2.63 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.185 2.59 . . . . 0.0 112.094 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.567 ' HA ' ' HD1' ' A' ' 18' ' ' PHE . 1.6 m -120.04 179.85 1.95 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.722 -172.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 5.2 t -67.36 130.69 43.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.626 178.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.757 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttp -77.81 -30.43 51.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.578 -177.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -149.09 -89.07 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -171.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 4.9 mt -95.97 122.43 47.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.51 -169.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.428 HG23 ' HB3' ' A' ' 109' ' ' ASP . 0.0 OUTLIER -83.36 128.88 38.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.706 179.329 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.447 ' HB3' ' SG ' ' A' ' 35' ' ' CYS . . . -154.5 170.36 21.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.601 -178.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -115.31 124.0 50.17 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.978 0.418 . . . . 0.0 110.97 179.825 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 1.047 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 3.2 m -114.65 119.56 39.37 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.936 -178.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.473 ' O ' HD21 ' A' ' 56' ' ' LEU . 68.6 Cg_endo -75.5 139.74 23.36 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.327 2.018 . . . . 0.0 111.672 174.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.29 140.86 40.14 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 174.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 118.15 -91.99 0.53 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.634 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.42 HG22 ' O ' ' A' ' 55' ' ' LEU . 0.3 OUTLIER -141.17 179.32 6.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.674 0.273 . . . . 0.0 111.134 -175.261 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.494 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.2 OUTLIER 65.67 -167.59 0.21 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.383 -0.826 . . . . 0.0 113.045 174.455 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.566 ' CB ' ' HA ' ' A' ' 60' ' ' SER . 80.4 m-20 -98.03 173.3 7.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.656 0.741 . . . . 0.0 112.67 -162.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 29.2 m -112.28 141.71 45.66 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.1 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.4 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 0.9 OUTLIER -95.58 143.57 11.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 120.821 0.343 . . . . 0.0 110.344 178.369 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -105.34 115.29 30.01 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 8.9 p -91.24 0.53 8.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.753 0.787 . . . . 0.0 111.37 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.428 ' HB3' HG23 ' A' ' 95' ' ' VAL . 28.9 t0 -148.63 146.83 28.38 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.857 175.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -121.54 13.24 10.89 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.382 -177.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -116.55 -62.93 1.52 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -177.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 83.73 74.2 1.23 Allowed Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 -172.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -78.01 88.85 4.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.942 0.401 . . . . 0.0 111.482 -175.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 89.65 -159.23 28.02 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.576 176.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 3.6 p -103.36 -79.43 0.54 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.332 0.587 . . . . 0.0 110.485 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.509 ' HG2' HG21 ' A' ' 90' ' ' VAL . 0.2 OUTLIER -150.88 20.9 0.79 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.885 177.307 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -110.49 117.35 33.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.47 -175.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.008 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.415 176.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.477 0.916 0 CA-C-O 120.601 0.239 . . . . 0.0 110.661 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.483 HD22 ' HA ' ' A' ' 2' ' ' LEU . 0.2 OUTLIER -178.33 115.62 0.24 Allowed Pre-proline 0 C--O 1.234 0.287 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.582 179.886 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.46 88.57 0.41 Allowed 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 123.164 2.576 . . . . 0.0 112.416 179.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -95.26 168.2 10.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.33 177.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.43 158.65 31.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.91 178.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 66.72 68.91 0.42 Allowed 'General case' 0 N--CA 1.463 0.199 0 O-C-N 123.813 0.696 . . . . 0.0 111.228 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -140.91 145.19 35.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.896 178.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -99.49 74.97 1.93 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.291 0.567 . . . . 0.0 110.407 -177.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -133.61 114.04 13.07 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.174 0.512 . . . . 0.0 111.375 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.76 133.66 3.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.794 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.811 ' HB3' ' HB2' ' A' ' 15' ' ' SER . 1.1 mtmt -126.07 144.29 50.78 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.416 -179.343 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.71 ' HG ' ' OG ' ' A' ' 15' ' ' SER . 0.1 OUTLIER -81.0 74.88 7.99 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 177.081 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 72.35 -31.0 0.22 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.771 0.829 . . . . 0.0 111.634 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.447 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -149.12 -68.56 0.21 Allowed 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.753 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.811 ' HB2' ' HB3' ' A' ' 11' ' ' LYS . 2.3 m 67.3 -67.95 0.16 Allowed 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.427 0.691 . . . . 0.0 112.555 176.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.771 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . 56.8 -87.39 0.02 OUTLIER 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.421 0.688 . . . . 0.0 111.21 -175.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.458 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . . . -71.24 -35.77 71.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.876 0.37 . . . . 0.0 110.614 -179.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.497 ' HB2' HG12 ' A' ' 90' ' ' VAL . 19.9 t80 -70.52 -16.71 62.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.618 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.75 -15.45 59.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.963 0.411 . . . . 0.0 110.549 177.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.458 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 3.4 mttt -83.26 -24.35 32.31 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 175.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -32.45 72.91 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.241 176.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.27 -17.14 64.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.879 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -101.09 -50.54 3.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.602 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.83 -17.78 69.75 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.704 -178.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.5 m -119.67 134.94 55.02 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.36 97.49 9.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.964 0.412 . . . . 0.0 110.98 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -140.32 -178.19 5.37 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.419 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -120.91 172.2 8.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.568 0.223 . . . . 0.0 110.94 -175.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.408 HG13 ' N ' ' A' ' 30' ' ' GLY . 14.5 p -61.77 -45.58 98.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.76 -175.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.408 ' N ' HG13 ' A' ' 29' ' ' VAL . . . -100.62 20.01 50.04 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.771 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 1.2 m -125.98 -5.58 6.79 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.552 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -80.09 126.45 39.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.573 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -148.25 160.31 43.08 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.291 0.567 . . . . 0.0 111.966 -170.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 m -114.58 139.23 49.77 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.428 174.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.414 ' HB3' ' HB ' ' A' ' 94' ' ' ILE . 0.5 OUTLIER -124.62 160.16 29.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.838 0.351 . . . . 0.0 110.853 -176.591 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -145.74 160.03 42.31 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.758 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -51.4 150.69 6.12 Favored Pre-proline 0 CA--C 1.536 0.44 0 O-C-N 123.549 0.531 . . . . 0.0 111.321 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 47.2 Cg_exo -53.47 -49.02 18.82 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.082 2.521 . . . . 0.0 113.3 -171.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.06 -11.41 60.94 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -174.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' A' ' 43' ' ' ASN . 0.1 OUTLIER -103.27 -43.85 5.33 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.085 0.469 . . . . 0.0 110.035 179.881 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.826 HG21 ' H ' ' A' ' 66' ' ' ALA . 0.6 OUTLIER -65.84 -34.28 77.8 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.147 176.104 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.661 HD22 HG22 ' A' ' 41' ' ' THR . 1.2 m-80 -104.16 14.69 29.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.312 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.429 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 4.5 t-20 -47.58 -38.7 14.95 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.537 -176.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.642 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 9.8 t70 -113.2 142.18 46.09 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.0 -35.21 74.54 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.231 0.332 . . . . 0.0 111.149 -179.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.37 -32.33 58.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.921 0.391 . . . . 0.0 109.954 178.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.642 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.6 OUTLIER -61.72 -39.36 91.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.522 -179.128 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.66 ' HA ' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -58.22 -31.38 67.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.478 179.505 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -84.13 -30.31 28.68 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.911 178.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.422 ' HG ' HD13 ' A' ' 76' ' ' LEU . 1.4 mp -69.28 -20.93 63.91 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.815 0.34 . . . . 0.0 111.096 -178.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.66 HD12 ' HA ' ' A' ' 48' ' ' SER . 3.3 mt -74.01 -14.1 60.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.532 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.666 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -126.97 76.42 0.4 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.599 -0.81 . . . . 0.0 111.621 -177.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.91 -20.35 33.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.969 0.414 . . . . 0.0 110.798 -176.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -139.01 68.23 0.5 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.509 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 mt 53.03 45.89 27.86 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.389 0.614 . . . . 0.0 111.112 177.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.666 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -84.73 161.19 20.11 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.351 -177.305 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.588 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 30.8 t-20 -126.08 -177.68 4.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.875 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -100.03 -152.77 26.9 Favored Glycine 0 C--O 1.225 -0.444 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.009 -176.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.818 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -70.35 146.37 50.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.979 0.419 . . . . 0.0 110.864 179.938 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.4 m -59.23 98.04 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.516 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.39 4.89 65.79 Favored Glycine 0 C--O 1.229 -0.203 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.424 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.818 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 18.8 t30 -128.93 100.56 5.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.181 0.515 . . . . 0.0 110.796 -177.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.19 71.85 9.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.282 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -166.21 -61.71 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.981 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.71 113.44 18.9 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.023 0.439 . . . . 0.0 110.973 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.826 ' H ' HG21 ' A' ' 41' ' ' THR . . . -107.53 153.71 22.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.216 173.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.604 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 0.1 OUTLIER -126.53 141.04 52.0 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.538 -175.5 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.922 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -105.41 128.6 53.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.333 0.587 . . . . 0.0 110.043 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.65 ' HG2' ' HB2' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -76.83 170.17 16.96 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.724 -176.808 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.482 ' HB2' HD22 ' A' ' 12' ' ' LEU . . . -60.55 -27.74 67.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.879 0.371 . . . . 0.0 111.308 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.55 -31.11 63.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.945 0.879 . . . . 0.0 109.071 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.65 ' HB2' ' HG2' ' A' ' 69' ' ' LYS . 0.5 OUTLIER -80.96 -27.07 36.16 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.277 178.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 69' ' ' LYS . 23.8 mm -64.6 -42.77 96.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.724 176.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -20.57 63.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.385 177.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.474 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -70.38 -53.83 14.96 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.504 -177.075 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.422 HD13 ' HG ' ' A' ' 50' ' ' LEU . 0.7 OUTLIER -136.95 -5.92 1.89 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -171.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.44 51.92 7.01 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 119.799 -1.191 . . . . 0.0 112.12 -178.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.408 ' O ' HG23 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -62.36 83.68 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.968 0.413 . . . . 0.0 111.781 -176.962 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.416 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -71.91 4.85 3.01 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -175.191 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.63 -23.13 42.82 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -175.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.922 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -125.57 -4.47 7.16 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.22 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.509 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -115.94 138.22 47.09 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.525 0 CA-C-O 121.513 0.673 . . . . 0.0 111.789 -177.382 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.859 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 21.7 t70 -112.96 153.44 28.02 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.962 -1.017 . . . . 0.0 108.578 176.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -117.65 103.33 9.93 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.998 -174.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 78.3 p -104.75 -168.69 1.51 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.396 175.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.401 ' HG2' ' H ' ' A' ' 86' ' ' GLU . 0.4 OUTLIER -66.03 -25.32 67.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.771 0.32 . . . . 0.0 111.043 179.521 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.771 ' HB3' ' HB3' ' A' ' 16' ' ' ALA . 2.5 mp0 -71.54 -32.01 67.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.286 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 130.2 -146.1 17.2 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.481 -0.866 . . . . 0.0 111.794 -178.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -74.76 108.7 2.76 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.958 2.439 . . . . 0.0 111.346 175.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.497 HG12 ' HB2' ' A' ' 18' ' ' PHE . 0.6 OUTLIER -122.41 162.51 22.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.05 -179.231 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -67.27 124.17 22.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.941 0.401 . . . . 0.0 110.52 -177.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.859 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 2.4 tttp -70.83 -24.0 62.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.827 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.444 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -152.8 -95.18 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.14 -174.343 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.444 HG13 ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -92.81 136.77 23.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.597 -173.024 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -97.61 129.23 48.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 172.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -140.8 163.8 31.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.921 0.391 . . . . 0.0 111.363 -174.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.84 109.08 19.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.159 177.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.771 ' O ' ' HA ' ' A' ' 31' ' ' SER . 64.1 m -110.87 116.79 51.51 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.505 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.0 132.9 14.56 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.273 1.982 . . . . 0.0 111.934 177.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.12 120.18 23.28 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.086 176.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.5 ' O ' ' HB ' ' A' ' 102' ' ' THR . . . 137.87 -52.01 0.76 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.077 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.5 ' HB ' ' O ' ' A' ' 101' ' ' GLY . 5.1 t 176.33 177.52 0.24 Allowed 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.506 -0.183 . . . . 0.0 110.506 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 76.34 157.75 0.19 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.023 0.929 . . . . 0.0 112.517 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.588 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.3 OUTLIER -75.08 175.52 8.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.818 -175.023 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 10.9 m -112.11 141.9 45.22 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.884 -178.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.7 m -91.88 138.94 18.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.616 174.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.7 128.93 44.73 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -94.61 7.03 6.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.591 0.71 . . . . 0.0 110.781 -178.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -121.5 142.56 49.93 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.38 172.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -142.04 20.25 2.11 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.74 -178.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -135.46 -37.93 0.76 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.311 -177.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 86.05 55.09 2.58 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -176.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -112.46 179.07 4.09 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 110.545 -0.169 . . . . 0.0 110.545 -178.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -77.47 80.98 1.25 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.292 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.46 80.38 5.84 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.762 0.315 . . . . 0.0 110.915 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.61 30.0 0.07 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.149 176.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -121.47 143.77 49.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.688 -175.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.432 ' OXT' ' HG3' ' A' ' 118' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.021 -0.99 . . . . 0.0 108.999 177.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.477 0.899 0 CA-C-O 120.279 0.085 . . . . 0.0 110.804 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 65.44 91.05 0.08 OUTLIER Pre-proline 0 N--CA 1.466 0.343 0 C-N-CA 123.026 0.53 . . . . 0.0 111.597 176.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.29 64.39 7.14 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 123.009 2.473 . . . . 0.0 112.151 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -76.97 -70.69 0.45 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.573 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 p -124.68 -93.07 0.51 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.868 0.366 . . . . 0.0 110.689 176.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.48 -11.57 23.65 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.557 -177.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.86 54.96 9.66 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 123.62 0.575 . . . . 0.0 111.627 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.72 101.49 4.31 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.375 -178.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -145.89 -8.1 0.55 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.722 -177.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -118.66 140.45 49.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.006 0.431 . . . . 0.0 111.825 -172.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.47 -59.78 1.21 Allowed 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.794 174.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.459 HD22 ' HA ' ' A' ' 12' ' ' LEU . 1.0 OUTLIER 75.53 -61.46 0.47 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.729 175.6 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.98 -41.37 64.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.161 0.505 . . . . 0.0 110.5 -178.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.21 6.39 8.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.901 -178.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.519 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 15.2 m -72.92 -25.78 61.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.14 174.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.94 -53.51 0.51 Allowed 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.906 0.754 . . . . 0.0 111.354 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.616 ' HB1' ' HB2' ' A' ' 116' ' ' LYS . . . -63.1 -33.01 74.54 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.858 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.605 ' HE2' ' SG ' ' A' ' 34' ' ' CYS . 15.9 t80 -72.14 -28.46 63.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.151 177.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.33 -22.32 63.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.748 177.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.542 ' HE2' ' HA ' ' A' ' 17' ' ' ALA . 55.4 mttm -67.63 -29.58 68.94 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.82 -31.91 73.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.639 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.13 -18.63 63.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.526 -177.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -108.66 -25.1 11.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.783 179.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -77.13 -26.43 61.97 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.319 179.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.769 HG21 HG21 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -137.99 155.44 48.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.666 0.269 . . . . 0.0 110.433 -179.649 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.16 95.73 9.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.198 0.523 . . . . 0.0 110.414 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -148.44 132.25 17.01 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.642 175.908 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -80.38 173.71 12.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.318 -177.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.8 p -55.78 -41.76 67.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 120.751 0.31 . . . . 0.0 111.356 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -95.36 12.36 68.02 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.295 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.576 ' HA ' ' HA ' ' A' ' 99' ' ' PRO . 0.7 OUTLIER -130.68 16.35 5.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.949 0.404 . . . . 0.0 110.637 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -106.49 133.14 51.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 175.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.509 ' CB ' ' HB3' ' A' ' 98' ' ' CYS . . . -150.45 178.97 8.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.503 0.668 . . . . 0.0 112.319 -171.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.605 ' SG ' ' HE2' ' A' ' 18' ' ' PHE . 3.8 m -127.45 135.07 49.9 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.792 -1.095 . . . . 0.0 108.806 171.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.551 ' HB3' ' HB ' ' A' ' 94' ' ' ILE . 0.4 OUTLIER -110.92 158.41 18.77 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.111 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.643 ' OD1' ' HB3' ' A' ' 40' ' ' GLU . 11.0 t-20 -148.96 159.24 44.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.679 0.276 . . . . 0.0 110.843 -172.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.465 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -50.61 132.71 27.13 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.528 177.489 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 37' ' ' SER . 63.8 Cg_exo -53.38 -43.3 58.63 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.31 2.673 . . . . 0.0 113.42 -177.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.09 -8.12 52.82 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.969 0.414 . . . . 0.0 111.029 -177.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.643 ' HB3' ' OD1' ' A' ' 36' ' ' ASN . 1.5 tt0 -103.47 -46.81 4.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.563 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 43.8 m -60.18 -38.12 82.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.978 176.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.403 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -102.41 14.74 31.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.006 -177.541 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -62.4 -42.02 99.11 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.144 -177.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 1.046 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 21.7 t70 -87.57 140.88 29.07 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.531 178.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.26 -40.24 89.62 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.825 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.62 -19.73 22.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.046 -175.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 1.046 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -57.24 -35.64 69.96 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.209 -179.729 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.42 -23.32 67.35 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.87 0.366 . . . . 0.0 111.386 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -100.7 -19.07 18.83 Favored Glycine 0 C--N 1.33 0.229 0 N-CA-C 111.283 -0.727 . . . . 0.0 111.283 174.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.606 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 2.3 tp -64.34 -35.06 79.65 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 122.596 0.359 . . . . 0.0 110.904 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.57 ' HB2' HD22 ' A' ' 56' ' ' LEU . 0.2 OUTLIER -72.43 -34.55 67.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.172 0.511 . . . . 0.0 110.637 178.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.21 53.37 4.76 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.568 -175.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.79 -27.48 61.16 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.4 0.619 . . . . 0.0 110.527 178.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -137.9 -94.28 0.33 Allowed Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.519 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.58 ' HB3' ' HA2' ' A' ' 101' ' ' GLY . 0.5 OUTLIER -130.23 58.82 1.65 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.94 0.4 . . . . 0.0 110.027 178.448 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.57 HD22 ' HB2' ' A' ' 51' ' ' LEU . 0.5 OUTLIER -80.81 103.1 10.43 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.59 0.71 . . . . 0.0 110.146 177.885 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.689 HD22 ' HA ' ' A' ' 104' ' ' ASN . 2.2 p-10 -89.99 171.4 9.6 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 114.47 -1.241 . . . . 0.0 109.375 175.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.31 -160.12 34.3 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.581 -0.819 . . . . 0.0 113.168 -174.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.479 ' HA ' HD23 ' A' ' 59' ' ' LEU . 0.8 OUTLIER -67.98 159.33 30.88 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 122.545 0.338 . . . . 0.0 111.671 -178.303 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.586 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 0.4 OUTLIER -55.04 87.23 0.01 OUTLIER 'General case' 0 C--O 1.233 0.187 0 C-N-CA 123.841 0.856 . . . . 0.0 111.918 178.909 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.77 8.05 84.99 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.514 178.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -120.5 102.38 8.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.976 0.417 . . . . 0.0 111.509 -178.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.37 104.17 5.82 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.51 176.029 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 157.37 -61.38 0.33 Allowed Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.178 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.85 119.88 21.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.902 0.382 . . . . 0.0 110.073 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -114.27 135.83 53.64 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.197 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.07 132.36 56.68 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.882 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -103.78 129.32 51.18 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.055 0.455 . . . . 0.0 110.305 -177.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.474 ' HG3' ' HG2' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -75.63 168.03 20.79 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.323 -177.023 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.87 -31.88 67.13 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.678 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.6 -35.44 73.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.261 0.553 . . . . 0.0 109.541 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.696 HD12 HD11 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -76.89 -32.49 57.47 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.294 178.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.1 mt -60.81 -38.3 78.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.579 176.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.54 -24.47 49.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.033 177.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.408 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -77.04 -53.67 7.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.26 -0.427 . . . . 0.0 112.077 -175.406 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.606 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.9 OUTLIER -117.41 -24.43 7.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -172.9 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.89 50.59 6.85 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 119.974 -1.108 . . . . 0.0 112.367 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.696 HD11 HD12 ' A' ' 72' ' ' LEU . 2.4 mp -74.86 92.85 2.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.946 0.403 . . . . 0.0 110.735 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -77.46 6.51 6.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.713 -177.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.87 -44.86 79.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.236 0.541 . . . . 0.0 110.379 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.882 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -94.74 2.83 55.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.231 -176.808 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 16.3 t -115.22 138.29 46.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.234 0.54 . . . . 0.0 110.826 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.658 ' HB2' ' HD3' ' A' ' 92' ' ' LYS . 31.7 t0 -128.97 164.69 22.62 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 175.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -110.23 135.81 50.41 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.081 0.467 . . . . 0.0 111.513 -176.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.1 p -120.92 -169.51 1.84 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.343 176.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -66.93 -32.49 73.78 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.745 0.653 . . . . 0.0 109.941 174.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.519 ' HB3' ' O ' ' A' ' 15' ' ' SER . 0.5 OUTLIER -72.93 -54.81 7.72 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.873 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 166.43 -152.13 20.93 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.253 -0.975 . . . . 0.0 112.403 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -70.09 120.75 7.43 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 123.001 2.467 . . . . 0.0 111.022 174.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.4 -175.16 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.948 0.404 . . . . 0.0 111.064 -174.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.51 125.27 26.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.791 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.658 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 14.3 tptm -68.89 -41.46 78.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.82 -177.194 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -146.68 -63.36 0.3 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.575 -172.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.551 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 2.2 mt -109.19 122.15 63.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.99 0.424 . . . . 0.0 111.718 -173.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -85.46 126.92 40.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.806 175.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -154.29 152.58 30.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.303 -176.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 6.9 m -104.17 107.87 18.97 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 176.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.509 ' HB3' ' CB ' ' A' ' 33' ' ' ALA . 53.9 t -119.66 117.25 32.79 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.571 -173.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.66 ' HG2' HG21 ' A' ' 102' ' ' THR . 3.1 Cg_exo -80.01 154.8 22.76 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.047 2.498 . . . . 0.0 111.944 175.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.474 ' HG2' ' HG3' ' A' ' 69' ' ' LYS . 0.9 OUTLIER -88.27 100.89 13.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 171.885 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.58 ' HA2' ' HB3' ' A' ' 55' ' ' LEU . . . 110.73 68.42 0.57 Allowed Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.217 -0.992 . . . . 0.0 112.53 -178.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.66 HG21 ' HG2' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -146.28 -177.8 5.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.746 0.308 . . . . 0.0 111.081 -178.406 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 14.1 m -82.23 -47.88 11.92 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 172.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.689 ' HA ' HD22 ' A' ' 57' ' ' ASN . 18.0 p30 -154.63 163.69 39.86 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.138 174.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.509 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 34.7 m -112.34 141.99 45.4 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -97.25 132.21 42.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.184 0.516 . . . . 0.0 111.499 -172.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.45 130.97 35.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.503 173.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.769 HG21 HG21 ' A' ' 25' ' ' THR . 0.0 OUTLIER -108.98 25.13 2.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.938 -172.424 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -77.86 -55.48 5.28 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.501 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 9.0 m-80 69.06 -52.73 0.58 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.849 0.86 . . . . 0.0 112.157 177.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -129.19 -68.09 0.75 Allowed 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.987 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 170.51 89.35 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.185 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -79.8 -82.31 0.11 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.025 0.44 . . . . 0.0 110.19 178.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -166.96 -172.41 34.17 Favored Glycine 0 N--CA 1.445 -0.72 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.752 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.493 ' O ' ' HB3' ' A' ' 116' ' ' LYS . 0.8 OUTLIER -112.1 -15.98 13.14 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.585 0.231 . . . . 0.0 110.606 177.842 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.616 ' HB2' ' HB1' ' A' ' 17' ' ' ALA . 0.0 OUTLIER 164.71 3.39 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.21 -174.491 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . 0.442 ' H ' ' H ' ' A' ' 116' ' ' LYS . . . -121.17 78.88 1.45 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.145 0.498 . . . . 0.0 110.28 -177.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.248 1.012 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.861 -177.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.885 0 CA-C-O 120.579 0.228 . . . . 0.0 110.435 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.6 OUTLIER -116.87 119.07 35.79 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 175.745 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 2' ' ' LEU . 13.5 Cg_exo -71.27 64.18 2.74 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.459 2.773 . . . . 0.0 112.922 -177.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -96.21 -10.92 26.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.474 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 71.9 m -156.07 152.91 28.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.289 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.39 26.08 14.91 Favored 'General case' 0 N--CA 1.466 0.327 0 O-C-N 123.899 0.749 . . . . 0.0 111.938 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -90.11 67.44 6.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.934 0.397 . . . . 0.0 110.652 -179.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.5 mttm -140.83 137.53 33.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.367 -179.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 77.88 -36.16 0.21 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.414 0.686 . . . . 0.0 111.446 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 72.59 -85.05 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.562 0.745 . . . . 0.0 111.96 177.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.528 ' HB3' ' H ' ' A' ' 12' ' ' LEU . 5.1 mtmm -148.15 -153.24 0.48 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.204 0.526 . . . . 0.0 112.18 -173.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.528 ' H ' ' HB3' ' A' ' 11' ' ' LYS . 6.3 mp -78.01 51.6 0.99 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.616 -175.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 69.26 -32.28 0.22 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.968 0.907 . . . . 0.0 111.774 -178.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.497 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -156.51 -57.42 0.09 Allowed 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.432 ' OG ' ' HB3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER 47.6 46.78 17.86 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.189 -178.944 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.09 -62.02 2.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.943 0.401 . . . . 0.0 111.441 -173.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.467 ' HB1' ' HB3' ' A' ' 116' ' ' LYS . . . -76.11 -25.47 55.45 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.958 0.408 . . . . 0.0 110.76 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -64.66 -38.26 90.41 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.419 178.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.92 -19.92 64.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.492 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.88 -30.08 63.68 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -72.6 -26.16 61.59 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.289 176.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.0 -5.55 44.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.79 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -81.01 -21.36 40.27 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.151 0.501 . . . . 0.0 110.18 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.78 -27.71 49.51 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.703 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.415 ' OG1' HG11 ' A' ' 108' ' ' VAL . 0.3 OUTLIER -141.39 113.17 7.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.865 0.364 . . . . 0.0 110.942 -179.674 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.9 m -68.66 113.38 6.1 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.925 175.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.469 ' HB3' HG13 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -148.6 161.77 41.03 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.698 178.414 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.443 ' H ' ' HB2' ' A' ' 31' ' ' SER . 17.0 t-20 -87.44 171.49 10.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.777 -176.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.8 m -63.86 -36.81 77.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.831 0.348 . . . . 0.0 110.599 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -92.39 25.29 18.7 Favored Glycine 0 N--CA 1.451 -0.326 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 175.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.494 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 1.4 m -142.79 -9.19 0.81 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.069 0.462 . . . . 0.0 110.523 177.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.469 HG13 ' HB3' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -94.81 133.79 34.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 177.596 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.639 ' HB2' ' HG3' ' A' ' 69' ' ' LYS . . . -148.59 165.54 30.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.459 0.647 . . . . 0.0 112.625 -171.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.4 t -124.5 144.51 50.06 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.798 -1.092 . . . . 0.0 109.309 173.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.584 ' HB3' HG12 ' A' ' 94' ' ' ILE . 0.1 OUTLIER -124.41 155.53 38.67 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.771 0.319 . . . . 0.0 110.402 -179.311 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.424 HD22 ' HB2' ' A' ' 40' ' ' GLU . 1.6 t30 -134.59 159.49 41.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.737 178.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.38 142.9 67.58 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.789 178.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.415 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 74.2 Cg_exo -51.49 -33.04 45.73 Favored 'Trans proline' 0 N--CA 1.478 0.567 0 C-N-CA 123.797 2.998 . . . . 0.0 113.847 -174.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.83 -7.65 23.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.023 0.439 . . . . 0.0 111.56 -178.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.424 ' HB2' HD22 ' A' ' 36' ' ' ASN . 1.1 mt-10 -113.38 -39.98 3.98 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.202 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.19 -33.32 75.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.44 0.638 . . . . 0.0 110.61 176.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 2.2 m-80 -102.92 14.05 32.87 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.274 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -66.34 -28.95 69.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.614 -176.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.94 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 7.3 t0 -115.06 140.86 48.71 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.871 177.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -26.3 66.0 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.991 0.424 . . . . 0.0 110.745 177.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.466 ' HA ' HD13 ' A' ' 46' ' ' LEU . 1.0 OUTLIER -86.0 -24.0 26.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.175 177.756 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.94 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -62.12 -42.63 99.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.249 -177.436 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.591 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -65.38 -26.97 68.23 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.708 -175.562 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.84 -21.35 33.9 Favored Glycine 0 C--N 1.329 0.151 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.349 174.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.753 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 1.2 tp -70.72 -35.82 72.9 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.473 -0.363 . . . . 0.0 110.564 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.591 HD21 ' HA ' ' A' ' 48' ' ' SER . 1.6 pp -74.15 -26.13 60.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.241 -178.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.95 58.01 2.88 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.696 -177.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.701 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -79.55 59.61 3.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.075 0.464 . . . . 0.0 111.575 -176.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 120.22 70.14 0.31 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.615 176.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 15.0 mt 56.59 32.55 21.14 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.351 0.596 . . . . 0.0 111.363 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.88 145.0 31.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.099 -177.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.686 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 4.6 t-20 -120.68 -178.24 3.67 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.416 ' HA3' ' HA ' ' A' ' 66' ' ' ALA . . . -116.3 -122.7 3.44 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.521 -0.847 . . . . 0.0 112.245 -175.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.963 HD23 ' HB2' ' A' ' 65' ' ' SER . 1.8 mm? -65.31 144.09 57.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.683 0.277 . . . . 0.0 110.726 -179.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.58 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -58.17 94.16 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.813 -179.793 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.42 -8.02 79.51 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 121.125 -0.56 . . . . 0.0 113.237 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -105.57 141.46 36.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.446 0.641 . . . . 0.0 111.583 -175.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -104.37 136.37 44.08 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.78 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 112.74 -39.29 2.91 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.886 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.963 ' HB2' HD23 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -97.46 116.22 29.25 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.592 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.453 ' HB1' HD13 ' A' ' 51' ' ' LEU . . . -128.32 150.81 49.91 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.491 -178.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -129.97 146.72 51.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.673 0.273 . . . . 0.0 110.932 -177.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.516 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -114.83 155.21 27.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.156 178.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.639 ' HG3' ' HB2' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -100.44 174.85 5.91 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.814 -173.545 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.452 ' O ' ' HB ' ' A' ' 73' ' ' ILE . . . -61.3 -39.34 90.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.111 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.5 -36.42 83.79 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.979 0.418 . . . . 0.0 110.488 177.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.701 HD11 ' HB3' ' A' ' 53' ' ' ALA . 1.2 tp -72.88 -21.85 60.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.844 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.452 ' HB ' ' O ' ' A' ' 70' ' ' ALA . 0.2 OUTLIER -60.43 -40.22 83.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.874 176.369 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -88.27 2.17 52.96 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.317 0.58 . . . . 0.0 110.736 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.66 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.4 OUTLIER -94.23 -53.66 3.86 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.062 -177.861 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.753 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.8 OUTLIER -121.02 -16.05 8.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 -174.246 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.77 49.09 45.0 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.326 -0.94 . . . . 0.0 112.075 -179.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.44 ' H ' HD12 ' A' ' 78' ' ' LEU . 0.7 OUTLIER -76.72 98.47 4.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.905 0.383 . . . . 0.0 111.272 -176.194 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 3.82 11.3 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.406 179.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.46 -41.11 80.67 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -177.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.516 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -116.83 4.0 12.94 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -174.097 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.4 t -111.18 136.71 46.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.292 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.717 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 5.5 t0 -119.33 168.19 11.17 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -129.97 99.1 4.97 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.936 0.398 . . . . 0.0 111.189 -177.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 41.4 p -96.88 -169.09 1.81 Allowed 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 173.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -81.87 8.22 10.88 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.313 0.578 . . . . 0.0 110.081 175.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -104.74 4.29 32.24 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.645 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 99.69 -161.24 19.55 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.139 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -65.2 116.9 4.12 Favored 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.853 2.369 . . . . 0.0 111.237 173.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.515 ' HB ' ' HD3' ' A' ' 116' ' ' LYS . 2.5 m -134.19 177.78 6.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.04 0.448 . . . . 0.0 111.717 -172.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.7 130.89 44.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.473 177.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.717 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttm -82.38 -32.89 28.96 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.884 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -141.8 -94.55 0.13 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.768 -174.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.584 HG12 ' HB3' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -107.0 147.73 11.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.015 0.436 . . . . 0.0 111.217 -172.748 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.439 HG13 HG12 ' A' ' 108' ' ' VAL . 3.3 p -100.66 139.55 21.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.431 -179.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.49 160.67 41.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.001 0.429 . . . . 0.0 111.694 -175.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 1.3 m -104.89 107.73 18.86 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 174.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.689 ' HA ' ' HB3' ' A' ' 105' ' ' CYS . 9.9 t -124.62 108.47 28.79 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.901 -169.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.532 ' HD2' ' SG ' ' A' ' 105' ' ' CYS . 56.9 Cg_endo -69.47 126.71 13.83 Favored 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 122.633 2.222 . . . . 0.0 112.568 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.17 104.43 6.69 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 164.11 -67.46 0.22 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.399 -0.905 . . . . 0.0 112.687 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -161.59 159.13 27.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.751 0.276 . . . . 0.0 111.353 -177.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.563 HG22 ' H ' ' A' ' 104' ' ' ASN . 1.3 m 72.53 166.95 0.31 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.584 0.707 . . . . 0.0 112.699 171.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.686 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.4 OUTLIER -74.46 163.5 27.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.312 -172.036 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.689 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 9.3 m -120.34 144.59 47.78 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.941 -175.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -90.66 148.31 4.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.482 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.52 140.39 43.36 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.497 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.439 HG12 HG13 ' A' ' 95' ' ' VAL . 0.8 OUTLIER -100.98 -0.26 10.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.512 0.672 . . . . 0.0 111.051 -178.341 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.414 ' OD2' ' HB ' ' A' ' 94' ' ' ILE . 1.9 t70 -99.01 163.72 12.47 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.284 176.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -130.57 -8.19 4.11 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.567 0.581 . . . . 0.0 112.567 -177.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -159.86 24.31 0.18 Allowed 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -174.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . 0.576 ' HA2' HG22 ' A' ' 94' ' ' ILE . . . 69.92 33.75 70.66 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.518 178.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.74 67.16 8.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.188 0.518 . . . . 0.0 110.623 -178.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -92.79 61.21 2.35 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.384 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.02 -21.32 64.13 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.645 0.259 . . . . 0.0 110.969 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.515 ' HD3' ' HB ' ' A' ' 90' ' ' VAL . 2.1 mtmp? 70.23 -74.12 0.09 Allowed 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 123.321 0.649 . . . . 0.0 110.866 -177.038 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -118.88 113.23 20.72 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 117.963 -1.018 . . . . 0.0 108.967 -177.007 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.457 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 1.1 mp -127.64 140.06 37.02 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.481 -179.081 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 2' ' ' LEU . 11.9 Cg_exo -70.78 -36.42 8.11 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.803 2.335 . . . . 0.0 112.082 177.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 54.88 31.93 16.79 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 175.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.8 m 63.23 21.58 12.91 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.805 -178.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.41 -9.45 35.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.471 176.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.29 -85.28 0.34 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.613 -175.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.9 tttt 59.4 60.1 2.43 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.312 0.577 . . . . 0.0 109.462 -172.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -100.72 -43.29 6.18 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.562 -171.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 48.69 74.4 0.18 Allowed 'General case' 0 C--O 1.233 0.217 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 178.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 59.8 mttt -58.94 -82.91 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 172.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 68.3 -55.78 0.51 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 114.647 -1.16 . . . . 0.0 112.162 176.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.14 -32.18 38.95 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.631 -177.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.73 5.11 4.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.863 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 87' ' ' GLU . 94.5 p -80.97 -34.33 33.2 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.09 -53.22 0.47 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.914 0.886 . . . . 0.0 111.27 -175.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.66 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . . . -66.82 -24.55 66.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.77 -177.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.631 ' HB2' HG12 ' A' ' 90' ' ' VAL . 36.3 t80 -87.9 -25.99 22.96 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.17 174.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.43 -40.21 93.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.272 178.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.66 ' HD3' ' HA ' ' A' ' 17' ' ' ALA . 0.0 OUTLIER -69.54 -24.51 63.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.462 0.649 . . . . 0.0 109.815 176.599 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.615 HE21 ' HA ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -74.63 -34.01 62.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.05 177.58 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.68 ' HB1' HD11 ' A' ' 32' ' ' ILE . . . -67.78 -18.51 64.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.758 -177.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -87.05 -1.14 57.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.984 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -73.98 -26.37 69.09 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.069 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.56 172.32 13.06 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.99 96.9 1.36 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.986 0.422 . . . . 0.0 109.936 173.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 66.7 m -130.49 134.59 47.2 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.85 -175.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -145.45 -163.08 1.64 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.463 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 p -61.96 135.23 26.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.996 0.427 . . . . 0.0 110.121 177.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.93 -8.19 4.82 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 120.964 -0.636 . . . . 0.0 113.226 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -114.1 -6.35 13.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.952 0.405 . . . . 0.0 110.698 179.936 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.68 HD11 ' HB1' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -91.68 128.79 43.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.84 177.2 10.03 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.063 0.458 . . . . 0.0 111.707 -174.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.3 m -140.54 147.47 39.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.625 173.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -128.33 160.27 32.71 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.238 0.542 . . . . 0.0 111.039 -176.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 42.6 t-20 -153.78 159.98 42.09 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.129 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -48.58 137.88 12.13 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 123.636 0.585 . . . . 0.0 111.452 177.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.589 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 10.0 Cg_endo -52.91 -35.21 69.88 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.281 2.654 . . . . 0.0 112.94 -179.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.44 -19.88 62.47 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.82 0.343 . . . . 0.0 111.735 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -91.92 -52.45 4.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.136 0.493 . . . . 0.0 110.018 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.552 ' O ' ' HB3' ' A' ' 47' ' ' LEU . 1.2 t -69.99 -21.05 63.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.643 -177.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.589 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -105.94 7.46 32.1 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.478 -179.043 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -66.8 -34.49 77.93 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.323 0.582 . . . . 0.0 110.704 -178.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 1.099 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 13.3 t0 -96.37 134.68 39.22 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.216 177.479 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.19 -24.82 68.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.815 0.341 . . . . 0.0 111.244 -179.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.2 tp -91.76 -22.08 20.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.935 0.398 . . . . 0.0 110.831 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 1.099 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -66.08 -31.68 72.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.007 -177.144 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.593 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -67.94 -14.52 63.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.243 -179.052 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -104.82 -20.03 10.37 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.598 173.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.463 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 1.1 mp -73.35 -22.37 60.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.889 0.376 . . . . 0.0 111.185 -177.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.593 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.3 OUTLIER -75.63 -12.55 60.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.327 -178.737 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.434 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -138.27 86.53 0.22 Allowed Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.561 -178.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.59 ' HB2' HD21 ' A' ' 72' ' ' LEU . . . -65.37 -21.69 66.71 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -177.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.59 67.12 0.37 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.353 -0.927 . . . . 0.0 113.044 179.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 mp 61.49 40.89 13.28 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.157 0.503 . . . . 0.0 111.74 173.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.451 HD11 ' H ' ' A' ' 101' ' ' GLY . 0.1 OUTLIER -72.86 172.45 10.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.414 -178.371 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -117.03 -177.83 3.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.86 -176.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -116.34 -151.49 9.65 Favored Glycine 0 C--O 1.228 -0.271 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.209 -175.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.415 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -66.43 134.75 53.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.839 0.352 . . . . 0.0 110.308 177.958 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.48 105.78 1.01 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.798 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 102.15 -38.7 3.06 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.453 176.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -95.98 102.87 14.72 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.666 0.27 . . . . 0.0 110.653 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.15 71.38 2.89 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.015 0.436 . . . . 0.0 111.103 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -160.83 -58.76 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.012 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.18 139.62 44.57 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.877 0.37 . . . . 0.0 111.158 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.31 131.68 48.65 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 m -115.71 131.69 56.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.103 0.477 . . . . 0.0 110.688 -176.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -104.37 144.0 32.24 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.849 -177.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.731 ' HG3' ' HG2' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -89.82 161.26 16.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.49 -174.088 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.595 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -58.38 -25.64 62.28 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -175.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.86 -27.15 60.14 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.808 0.813 . . . . 0.0 109.005 -177.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.59 HD21 ' HB2' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -90.93 -17.12 26.94 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.306 -178.461 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.616 HG12 HG21 ' A' ' 82' ' ' VAL . 1.3 mt -66.15 -39.42 84.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.3 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.22 7.91 20.32 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.126 0.489 . . . . 0.0 110.731 177.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.504 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.8 OUTLIER -88.27 -53.41 4.71 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.763 -179.31 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.2 0.83 2.88 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -173.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.78 52.98 4.16 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 119.718 -1.229 . . . . 0.0 113.055 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.492 ' O ' HG23 ' A' ' 82' ' ' VAL . 4.5 mm? -67.97 66.56 0.1 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 122.663 0.385 . . . . 0.0 111.849 -178.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.34 -4.87 28.49 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -175.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.48 -31.23 42.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.76 0.314 . . . . 0.0 111.623 -176.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.0 mt -102.81 -21.95 13.96 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.955 0.407 . . . . 0.0 111.177 -174.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.616 HG21 HG12 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -110.28 138.17 39.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.196 178.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.695 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 16.5 t0 -110.78 158.66 18.42 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.748 176.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -116.28 116.33 27.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.257 0.551 . . . . 0.0 111.575 -177.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.5 p -107.94 -175.47 2.79 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.397 -0.82 . . . . 0.0 108.873 174.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -66.12 -27.74 68.28 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.805 0.336 . . . . 0.0 111.448 -177.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 15' ' ' SER . 1.1 pm0 -70.65 -39.59 73.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.032 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 151.62 -159.79 28.45 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.108 -178.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -71.57 122.31 8.48 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 123.056 2.504 . . . . 0.0 111.286 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.631 HG12 ' HB2' ' A' ' 18' ' ' PHE . 1.5 m -138.51 169.83 17.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.76 -175.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.56 127.21 31.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.724 0.297 . . . . 0.0 110.481 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.695 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 2.0 tttt -67.36 -64.45 0.85 Allowed 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.082 -173.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.48 -61.8 1.37 Allowed 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.512 -172.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.9 mt -108.83 119.24 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.107 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.4 p -79.85 112.05 17.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.416 0.627 . . . . 0.0 109.831 175.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -151.02 137.69 18.83 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.068 -176.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 1.2 m -104.66 149.87 25.19 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.975 0.417 . . . . 0.0 110.482 -176.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 31' ' ' SER . 7.2 t -148.08 136.35 11.25 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.079 -167.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -81.95 152.19 16.62 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.701 2.267 . . . . 0.0 111.927 178.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.731 ' HG2' ' HG3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -89.43 157.24 18.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.864 0.364 . . . . 0.0 110.094 175.532 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.451 ' H ' HD11 ' A' ' 56' ' ' LEU . . . 96.87 -56.31 1.32 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.068 -0.587 . . . . 0.0 111.99 -178.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.7 t -177.97 -173.77 0.4 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.7 m 74.75 148.66 0.1 Allowed 'General case' 0 C--N 1.33 -0.251 0 O-C-N 123.849 0.718 . . . . 0.0 111.195 -177.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -74.29 174.6 8.59 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.467 -175.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.98 146.82 34.61 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.894 177.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -102.05 138.44 26.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.853 0.359 . . . . 0.0 110.356 -177.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -110.48 108.32 18.28 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 4.9 p -74.88 -4.15 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.735 0.779 . . . . 0.0 111.622 -173.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.585 ' O ' ' HB2' ' A' ' 110' ' ' ASN . 0.0 OUTLIER -119.56 -26.08 5.84 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.41 179.585 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.585 ' HB2' ' O ' ' A' ' 109' ' ' ASP . 3.7 m-80 78.68 -60.49 0.38 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.352 -174.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -179.06 108.17 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.962 179.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 155.33 -20.55 0.55 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.791 176.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.437 ' H ' ' CG ' ' A' ' 109' ' ' ASP . . . -121.37 129.22 52.92 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.298 0.571 . . . . 0.0 111.501 -177.187 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -176.74 -162.96 28.24 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 178.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 56.04 46.41 21.81 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 120.95 0.405 . . . . 0.0 111.608 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.492 ' HA ' ' NE2' ' A' ' 21' ' ' GLN . 6.4 mtmt 72.61 14.2 5.18 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.292 173.065 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -72.31 105.48 4.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.065 0.46 . . . . 0.0 111.677 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.544 ' HB3' ' NZ ' ' A' ' 20' ' ' LYS . 3.1 tm-20 . . . . . 0 C--O 1.244 0.812 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 121.083 0.468 . . . . 0.0 110.438 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.534 HD23 ' HD2' ' A' ' 3' ' ' PRO . 0.1 OUTLIER -159.07 145.48 12.5 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.58 -176.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.534 ' HD2' HD23 ' A' ' 2' ' ' LEU . 50.6 Cg_exo -55.16 -51.01 11.16 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.244 1.963 . . . . 0.0 110.957 174.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.554 ' HA ' ' HB3' ' A' ' 7' ' ' ALA . . . 54.9 29.14 11.55 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.53 173.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.84 -45.8 33.86 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.366 0.603 . . . . 0.0 109.602 175.105 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -132.31 52.61 2.06 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.465 176.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.554 ' HB3' ' HA ' ' A' ' 4' ' ' ALA . . . -136.87 130.85 32.34 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.396 -177.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.663 ' HG3' ' HA3' ' A' ' 77' ' ' GLY . 1.2 tptt 63.73 48.26 3.34 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.392 0.615 . . . . 0.0 110.481 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -77.98 58.58 1.98 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.045 -179.388 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.434 ' HB1' HG23 ' A' ' 73' ' ' ILE . . . -117.15 100.08 7.48 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.311 -179.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -98.69 -59.76 1.67 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.361 179.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.505 ' HG ' HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER 73.44 -48.91 0.68 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.519 0.728 . . . . 0.0 112.474 174.495 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.83 -30.83 71.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.923 0.392 . . . . 0.0 111.239 -179.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.31 -17.15 56.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.407 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.15 74.43 6.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.43 179.129 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.65 -40.14 62.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.549 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.58 -31.0 71.04 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.893 -177.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.559 ' HB2' HG12 ' A' ' 90' ' ' VAL . 88.8 t80 -70.18 -43.95 69.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.118 0.485 . . . . 0.0 110.111 -179.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.22 -30.24 48.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.366 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -63.3 -35.46 80.43 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.664 0.745 . . . . 0.0 109.237 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -30.43 67.17 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.526 176.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.56 -8.54 56.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.649 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.89 -5.62 59.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.031 0.443 . . . . 0.0 110.273 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.24 -9.16 55.93 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.156 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.5 m -134.57 152.78 52.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.82 95.58 7.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.14 0.495 . . . . 0.0 111.655 -177.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.497 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -140.95 155.91 46.16 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 173.206 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -112.85 -179.32 3.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.533 0.206 . . . . 0.0 110.481 -174.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.1 m -60.38 138.07 21.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 176.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 80.11 -13.84 24.12 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.321 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.693 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -104.93 -2.94 23.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.79 0.295 . . . . 0.0 111.228 179.556 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.418 ' H ' HG12 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -81.26 106.12 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 176.9 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.658 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -122.25 144.92 48.68 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.991 0.424 . . . . 0.0 111.649 -173.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 5.5 t -107.98 133.37 52.4 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.519 174.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.716 ' HB2' ' HB ' ' A' ' 94' ' ' ILE . 37.5 m -112.68 149.66 32.58 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.51 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.496 ' HB2' HD23 ' A' ' 81' ' ' LEU . 38.1 t-20 -136.56 152.8 50.89 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 174.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m -45.8 133.8 6.6 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 123.485 0.49 . . . . 0.0 110.884 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.4 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 6.3 Cg_endo -47.02 -44.92 22.25 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 124.043 3.162 . . . . 0.0 114.351 -172.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.1 -11.24 60.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.952 0.406 . . . . 0.0 111.835 -176.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.92 -38.66 6.91 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.558 HG23 HD13 ' A' ' 47' ' ' LEU . 1.4 m -60.26 -43.12 96.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.21 173.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.4 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.6 OUTLIER -90.01 5.88 44.68 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.192 -176.564 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -81.19 -7.61 59.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.427 0.632 . . . . 0.0 109.646 175.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -96.34 144.16 26.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.349 177.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -82.32 -21.68 35.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.329 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.545 ' HB3' HD11 ' A' ' 78' ' ' LEU . 3.2 mp -82.06 -52.86 6.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.619 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.784 ' HA ' ' HB3' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -54.05 -36.62 63.28 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.935 179.994 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 t -58.75 -25.23 62.79 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.401 -178.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -105.72 -24.06 7.19 Favored Glycine 0 C--N 1.334 0.422 0 N-CA-C 111.534 -0.627 . . . . 0.0 111.534 173.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.784 ' HB3' ' HA ' ' A' ' 47' ' ' LEU . 0.4 OUTLIER -67.87 -20.06 65.09 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 122.75 0.42 . . . . 0.0 110.783 179.189 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.484 ' HG ' ' CB ' ' A' ' 66' ' ' ALA . 0.0 OUTLIER -46.08 -35.23 4.73 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.652 0.595 . . . . 0.0 111.736 177.489 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.8 79.34 0.32 Allowed Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.485 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.414 ' CB ' HD11 ' A' ' 72' ' ' LEU . . . -67.53 -28.34 67.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.556 0.693 . . . . 0.0 109.251 174.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -133.96 -107.55 0.99 Allowed Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 110.361 -1.096 . . . . 0.0 110.361 172.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.1 mt -117.68 47.13 1.6 Allowed 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 174.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.408 HD11 ' OE2' ' A' ' 100' ' ' GLU . 2.2 mt -78.0 176.17 9.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.877 -174.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.579 ' CB ' ' HA ' ' A' ' 104' ' ' ASN . 3.0 m120 -138.83 -177.43 4.87 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.737 -175.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -112.41 -135.86 6.59 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.671 -0.775 . . . . 0.0 112.089 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.657 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -64.88 150.23 48.11 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.855 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.458 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -55.06 89.07 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.094 0.557 . . . . 0.0 112.099 -179.78 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.92 2.29 61.14 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 121.079 -0.582 . . . . 0.0 112.443 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.657 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 32.5 t-20 -122.35 98.22 5.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.944 0.402 . . . . 0.0 110.345 -179.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.16 72.7 9.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.237 0.542 . . . . 0.0 111.134 178.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.72 -48.17 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 -179.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -81.23 113.47 19.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 174.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.484 ' CB ' ' HG ' ' A' ' 51' ' ' LEU . . . -105.78 156.05 18.69 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.835 0.35 . . . . 0.0 111.011 -176.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.4 m -134.42 141.73 46.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.041 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.636 ' HB2' HD21 ' A' ' 50' ' ' LEU . . . -108.06 126.01 52.24 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.935 0.398 . . . . 0.0 110.454 176.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.658 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -80.77 166.42 21.0 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.694 175.758 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -50.72 -38.42 47.18 Favored 'General case' 0 C--N 1.329 -0.297 0 O-C-N 123.433 0.458 . . . . 0.0 111.813 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.3 -37.31 80.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.592 179.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.781 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -82.77 -23.24 34.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.71 -178.292 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.505 HG21 ' HG ' ' A' ' 12' ' ' LEU . 2.4 mt -63.88 -40.26 88.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 173.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -83.74 -4.34 58.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.118 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.781 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -81.7 -53.46 6.2 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 120.972 0.415 . . . . 0.0 110.58 -179.245 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.557 HD22 ' HB2' ' A' ' 50' ' ' LEU . 6.7 mp -110.98 -21.92 11.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.015 -176.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.663 ' HA3' ' HG3' ' A' ' 8' ' ' LYS . . . 82.41 46.09 6.64 Favored Glycine 0 CA--C 1.511 -0.186 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.275 -176.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.727 HD13 HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -76.79 147.18 37.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -174.036 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.84 14.9 5.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.328 174.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.1 -25.65 43.01 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.023 0.44 . . . . 0.0 111.09 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.496 HD23 ' HB2' ' A' ' 36' ' ' ASN . 8.1 mt -109.68 4.13 21.66 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.704 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -116.71 138.24 47.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.353 0.597 . . . . 0.0 110.819 -176.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.625 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 6.8 t0 -119.62 144.12 47.3 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 175.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -103.94 112.15 25.0 Favored 'General case' 0 C--N 1.316 -0.854 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.067 -174.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.0 p -107.46 -169.36 1.52 Allowed 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.963 174.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.8 pm0 -61.62 -24.44 66.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.604 178.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.35 -34.41 31.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.727 0.299 . . . . 0.0 111.092 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 143.48 -160.03 27.6 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.115 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_exo -71.92 97.55 0.83 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.207 2.604 . . . . 0.0 111.463 175.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.559 HG12 ' HB2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -113.01 -174.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.899 -175.722 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.456 ' SG ' HG12 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -67.69 127.66 33.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.084 0.469 . . . . 0.0 110.832 -177.793 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.625 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 6.5 tptp -73.53 -36.73 65.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.622 -178.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -144.37 -78.53 0.2 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -170.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.844 HG23 ' HB3' ' A' ' 109' ' ' ASP . 4.6 mt -110.92 136.18 47.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.404 -170.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.456 HG12 ' SG ' ' A' ' 91' ' ' CYS . 13.2 m -101.76 139.65 22.36 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 120.738 0.304 . . . . 0.0 110.853 177.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -155.24 166.92 32.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.134 0.492 . . . . 0.0 111.81 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.497 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.8 m -113.2 117.71 32.65 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 173.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.693 ' O ' ' HA ' ' A' ' 31' ' ' SER . 39.8 t -123.6 124.46 26.21 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.504 -175.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -84.26 127.9 4.06 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.815 2.343 . . . . 0.0 113.028 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.408 ' OE2' HD11 ' A' ' 56' ' ' LEU . 0.7 OUTLIER -73.33 105.37 4.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.042 0.448 . . . . 0.0 110.519 175.074 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 169.54 -80.44 0.1 OUTLIER Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 176.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.51 161.32 32.74 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 122.728 0.411 . . . . 0.0 109.892 176.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 23.7 m 79.76 150.66 0.11 Allowed 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.779 0.674 . . . . 0.0 110.733 -179.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.579 ' HA ' ' CB ' ' A' ' 57' ' ' ASN . 0.3 OUTLIER -71.28 173.9 7.15 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -168.679 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.575 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.15 142.83 44.13 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.496 -177.624 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -99.16 127.91 51.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 121.061 0.458 . . . . 0.0 110.031 -177.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -94.48 136.01 35.27 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.818 177.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.71 -0.99 9.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.275 0.559 . . . . 0.0 111.271 -178.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.844 ' HB3' HG23 ' A' ' 94' ' ' ILE . 17.7 t0 -86.88 77.96 9.14 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.283 -179.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -138.53 -15.57 1.22 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.477 172.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -100.04 -1.7 36.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.005 176.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 104.96 93.77 2.32 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.738 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -92.76 -158.29 0.59 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 174.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -137.15 163.75 25.34 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.46 -0.876 . . . . 0.0 111.977 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.54 -62.19 1.5 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.351 0.596 . . . . 0.0 110.112 177.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.27 6.55 0.15 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.199 176.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -115.13 92.24 3.87 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.311 -174.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 . . . . . 0 C--O 1.251 1.144 0 CA-C-O 117.655 -1.164 . . . . 0.0 108.867 175.473 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.476 0.84 0 CA-C-O 120.738 0.304 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.472 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.2 OUTLIER -128.29 116.74 20.09 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-O 120.731 0.3 . . . . 0.0 110.725 -177.845 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 2' ' ' LEU . 4.4 Cg_exo -76.74 140.46 20.89 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.047 2.498 . . . . 0.0 111.304 176.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -149.59 -104.34 0.07 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.719 0.295 . . . . 0.0 110.564 -177.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.2 -20.95 60.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.198 0.523 . . . . 0.0 110.415 178.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -130.34 173.12 11.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.101 178.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 63.13 50.5 3.04 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.94 0.775 . . . . 0.0 111.227 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.41 37.77 2.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.946 -179.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -78.1 72.63 4.64 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.02 -178.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -87.73 -30.57 20.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.612 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -100.46 148.7 24.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.776 0.322 . . . . 0.0 110.478 -178.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.525 ' C ' ' H ' ' A' ' 14' ' ' THR . 7.9 mp -77.78 63.28 2.81 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.936 179.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 70.68 -24.98 0.16 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.808 0.843 . . . . 0.0 111.393 -178.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.525 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -170.57 -42.57 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.3 m 64.69 -74.45 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.416 -177.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.519 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . 52.99 -91.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.052 0.541 . . . . 0.0 111.307 -177.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.836 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . . . -63.15 -32.18 73.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.804 0.335 . . . . 0.0 110.526 177.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.523 ' HE2' ' SG ' ' A' ' 34' ' ' CYS . 28.5 t80 -68.71 -32.66 72.61 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.158 0.504 . . . . 0.0 110.05 176.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.34 -37.04 80.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.587 177.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.836 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 23.1 mttt -64.9 -36.96 86.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.38 0.609 . . . . 0.0 109.403 174.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -59.99 -40.87 90.63 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.309 174.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.21 -16.64 61.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.467 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.56 -40.44 11.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.658 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -75.83 -27.88 61.91 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.757 -177.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -114.33 146.23 40.78 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.586 0.231 . . . . 0.0 110.393 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.55 92.93 9.07 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 121.398 0.618 . . . . 0.0 111.208 -178.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.537 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -160.3 131.23 5.64 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 170.469 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -111.36 -175.15 2.63 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.517 -174.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.7 t -58.34 117.07 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.174 0.511 . . . . 0.0 109.849 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.538 ' O ' ' HA ' ' A' ' 99' ' ' PRO . . . 113.82 -23.68 12.87 Favored Glycine 0 N--CA 1.441 -1.001 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 -174.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.96 4.4 5.35 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.81 0.338 . . . . 0.0 111.2 178.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.448 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 5.3 tt -96.79 129.52 46.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.887 0.375 . . . . 0.0 110.807 -177.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.75 172.81 15.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.223 0.535 . . . . 0.0 111.929 -176.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.523 ' SG ' ' HE2' ' A' ' 18' ' ' PHE . 55.9 m -124.54 142.09 51.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.741 170.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -117.2 145.02 44.15 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.725 ' HB2' ' HB3' ' A' ' 81' ' ' LEU . 13.2 t-20 -131.6 159.74 37.37 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.942 0.401 . . . . 0.0 111.031 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -54.5 142.06 52.33 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.612 175.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.555 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 11.5 Cg_endo -55.39 -38.54 93.8 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 123.107 2.538 . . . . 0.0 112.795 -175.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.37 -16.69 64.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.963 0.411 . . . . 0.0 111.937 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -102.81 -42.68 5.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.526 179.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.66 -25.81 65.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.054 0.454 . . . . 0.0 110.841 178.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.555 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -104.84 14.29 29.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.4 179.499 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -62.32 -26.01 68.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.013 -175.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 1.026 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 14.6 t70 -122.03 150.85 41.51 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.588 0.232 . . . . 0.0 110.394 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.98 -35.03 79.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.216 -179.037 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.32 -15.99 26.64 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.464 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 1.026 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 5.0 tp -60.98 -40.94 95.35 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.085 -178.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -29.84 69.91 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.12 -177.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -84.59 -29.84 28.66 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.726 -0.749 . . . . 0.0 111.754 177.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.481 ' HA ' HD12 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -68.53 -20.81 64.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.919 0.39 . . . . 0.0 110.972 179.275 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.617 HD12 ' HB2' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -56.57 -30.99 63.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.236 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.608 ' HA3' ' HB2' ' A' ' 56' ' ' LEU . . . -137.24 100.07 0.31 Allowed Glycine 0 N--CA 1.441 -1.031 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.033 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.492 ' H ' HD21 ' A' ' 72' ' ' LEU . . . -75.1 55.14 0.72 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.107 0.479 . . . . 0.0 110.481 177.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 164.61 -118.08 0.79 Allowed Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.556 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.5 mp -120.02 52.89 1.1 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.933 0.397 . . . . 0.0 110.199 -177.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.608 ' HB2' ' HA3' ' A' ' 52' ' ' GLY . 0.3 OUTLIER -88.36 166.9 13.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.269 0.557 . . . . 0.0 111.828 -175.816 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.436 ' HB3' ' O ' ' A' ' 103' ' ' THR . 45.7 t30 -132.83 -179.13 5.29 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.384 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -101.64 -153.56 25.74 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.502 -0.856 . . . . 0.0 112.684 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.875 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 9.5 tp -67.38 143.47 56.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.561 0.22 . . . . 0.0 110.842 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.1 m -59.34 94.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.524 -179.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.62 -13.86 63.67 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.6 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.875 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 6.7 t-20 -99.72 92.22 5.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.021 0.439 . . . . 0.0 110.934 -177.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -76.14 72.22 2.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.049 176.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -179.46 -48.13 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.34 130.84 37.14 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.702 0.287 . . . . 0.0 110.397 176.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.02 164.58 14.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.204 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 0.2 OUTLIER -129.36 127.96 42.11 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 120.822 0.344 . . . . 0.0 110.169 -178.46 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 1.016 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -109.43 148.82 30.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.983 178.07 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' A' ' 32' ' ' ILE . 1.5 mppt? -92.46 168.25 11.4 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.614 -175.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.665 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -61.15 -32.62 72.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.197 -179.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.11 -48.6 77.84 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 176.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.514 ' HA ' HD13 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -57.78 -40.45 79.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.786 177.172 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.934 ' HA ' ' HB2' ' A' ' 78' ' ' LEU . 11.4 mt -60.73 -47.82 91.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.63 179.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.95 -30.64 70.83 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.1 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.437 ' C ' ' HG ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -62.58 -53.82 48.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.538 -171.231 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.437 ' HG ' ' C ' ' A' ' 75' ' ' GLN . 0.5 OUTLIER -138.67 25.53 2.59 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -171.247 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.508 ' O ' ' HG ' ' A' ' 79' ' ' LEU . . . 67.27 51.24 39.34 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 119.774 -1.203 . . . . 0.0 111.5 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.934 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 0.1 OUTLIER -73.53 72.57 1.4 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -174.227 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.798 ' HA ' ' HB ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -87.85 20.93 2.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.84 0.352 . . . . 0.0 110.905 178.092 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.432 ' HB2' ' HG ' ' A' ' 47' ' ' LEU . . . -65.1 -27.56 68.84 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.265 0.555 . . . . 0.0 110.558 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 1.016 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -132.52 13.09 4.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.123 179.502 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.798 ' HB ' ' HA ' ' A' ' 79' ' ' LEU . 53.8 t -115.36 137.3 49.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.615 -173.175 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -118.99 148.95 42.43 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 175.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 30.7 t-80 -109.87 115.49 29.91 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.089 -0.645 . . . . 0.0 111.65 -176.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.494 ' HB ' ' OE2' ' A' ' 87' ' ' GLU . 6.4 p -108.29 -173.92 2.39 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.466 174.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.47 -27.19 65.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.058 0.456 . . . . 0.0 110.051 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 16' ' ' ALA . 1.9 mp0 -68.33 -24.39 64.82 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.015 176.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 129.47 -158.54 22.17 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.418 178.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -73.79 120.21 6.29 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 123.188 2.592 . . . . 0.0 111.53 176.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.516 ' HB ' ' HE2' ' A' ' 116' ' ' LYS . 0.4 OUTLIER -137.56 166.86 23.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.282 -175.878 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 9.0 m -67.09 139.02 57.54 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.217 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.9 tttp -75.93 -49.85 16.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.643 -175.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -129.9 -86.0 0.53 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -170.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 5.6 mt -85.52 132.73 31.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.036 -168.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -94.5 123.79 46.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.386 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.428 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . . . -153.33 151.73 30.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.527 -178.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.537 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 3.7 m -105.45 123.59 48.14 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.281 0.562 . . . . 0.0 109.699 178.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 26.6 t -130.31 128.57 22.71 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.983 -172.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.538 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 10.5 Cg_exo -70.91 141.41 40.51 Favored 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.786 2.324 . . . . 0.0 112.275 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -88.2 103.99 16.29 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 171.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.437 ' H ' HD11 ' A' ' 56' ' ' LEU . . . 165.09 -78.65 0.13 Allowed Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.41 HG22 ' H ' ' A' ' 103' ' ' THR . 0.3 OUTLIER -155.33 -174.81 5.13 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.54 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.436 ' O ' ' HB3' ' A' ' 57' ' ' ASN . 23.8 p 62.99 178.22 0.15 Allowed 'General case' 0 C--O 1.235 0.302 0 O-C-N 124.177 0.923 . . . . 0.0 112.449 178.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -93.02 173.96 7.47 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.721 -168.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.442 ' O ' HD12 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -112.72 143.01 44.67 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.446 -176.308 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -87.46 141.82 13.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.917 0.389 . . . . 0.0 110.46 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.682 ' HB2' HD11 ' A' ' 59' ' ' LEU . . . -105.18 124.34 49.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.97 0.414 . . . . 0.0 110.902 -178.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -101.39 18.71 3.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.504 0.669 . . . . 0.0 109.828 178.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -76.65 70.3 3.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.208 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -135.6 20.52 3.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.779 -179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -113.04 166.4 11.45 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.354 -174.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -122.51 42.24 1.67 Allowed Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.947 -0.644 . . . . 0.0 111.529 179.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -103.73 -167.7 1.41 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.941 0.4 . . . . 0.0 110.753 -177.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -82.26 161.15 40.96 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.697 -0.763 . . . . 0.0 111.324 175.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.27 -56.31 23.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.15 0.5 . . . . 0.0 110.835 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.516 ' HE2' ' HB ' ' A' ' 90' ' ' VAL . 0.1 OUTLIER -168.04 24.42 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.688 175.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -103.36 79.14 1.68 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.409 -174.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.103 -0.951 . . . . 0.0 109.23 175.776 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -130.46 143.94 51.3 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.39 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -67.51 88.0 0.34 Allowed 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 122.625 2.217 . . . . 0.0 111.623 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.47 -48.67 68.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.891 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -148.52 -43.48 0.15 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.881 176.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -158.69 170.21 22.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.433 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -164.36 -68.19 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.66 177.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -163.51 44.47 0.11 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 176.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -90.02 114.74 26.67 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.949 -169.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 62.5 -169.92 0.18 Allowed 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.482 173.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.5 mttt 52.52 -143.44 0.7 Allowed 'General case' 0 C--N 1.338 0.092 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.752 -178.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.8 mp -96.1 51.3 1.22 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 177.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.403 ' O ' ' HB ' ' A' ' 14' ' ' THR . . . 54.04 67.09 1.06 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.607 -176.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.403 ' HB ' ' O ' ' A' ' 13' ' ' ALA . 37.4 m 79.28 -37.74 0.19 Allowed 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.245 -178.564 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.618 ' HB3' ' HB3' ' A' ' 18' ' ' PHE . 0.9 OUTLIER 54.41 53.11 11.29 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.855 0.36 . . . . 0.0 111.689 174.748 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.409 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . -58.16 -58.08 10.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.209 -177.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.634 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . . . -73.84 -16.96 61.12 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.249 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.618 ' HB3' ' HB3' ' A' ' 15' ' ' SER . 80.3 t80 -79.51 -35.75 39.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.863 0.364 . . . . 0.0 110.474 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.88 -30.43 71.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.862 0.363 . . . . 0.0 110.796 176.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.634 ' HD2' ' HA ' ' A' ' 17' ' ' ALA . 46.4 mttt -69.29 -20.47 63.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.399 0.618 . . . . 0.0 109.711 176.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.92 -46.12 10.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.401 177.521 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.79 -18.43 64.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.892 -171.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.1 -21.0 60.83 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.669 -177.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -101.36 3.5 54.36 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.39 -0.91 . . . . 0.0 112.75 -178.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.438 HG22 ' HB ' ' A' ' 108' ' ' VAL . 0.0 OUTLIER -121.99 134.25 54.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.933 0.366 . . . . 0.0 111.815 -175.381 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.48 96.97 4.84 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.178 174.597 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.588 ' SG ' ' HA ' ' A' ' 32' ' ' ILE . 0.5 OUTLIER -150.67 172.61 15.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.507 -179.289 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -123.85 159.39 29.71 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.739 -0.21 . . . . 0.0 110.589 -173.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 p -65.72 120.05 11.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.451 0.643 . . . . 0.0 110.144 178.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.84 -38.89 2.92 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.453 -175.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 0.8 OUTLIER -90.98 -1.62 57.8 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.032 0.444 . . . . 0.0 110.925 178.743 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.588 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 2.0 tt -80.25 134.47 27.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.644 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . . . -144.14 173.03 12.09 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.877 0.846 . . . . 0.0 113.115 -167.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 28.4 t -122.4 133.49 54.63 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.295 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.3 t -117.47 157.58 26.0 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.464 ' HB2' ' CD2' ' A' ' 81' ' ' LEU . 8.7 t-20 -149.07 159.33 44.33 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.743 -175.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.402 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.3 OUTLIER -53.82 135.62 55.98 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.641 174.676 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.454 ' HG3' ' OG ' ' A' ' 65' ' ' SER . 74.5 Cg_exo -47.29 -46.76 18.94 Favored 'Trans proline' 0 C--O 1.22 -0.388 0 C-N-CA 123.576 2.851 . . . . 0.0 113.834 -172.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.586 ' HA ' ' ND2' ' A' ' 42' ' ' ASN . . . -60.93 -9.41 4.17 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -173.628 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.593 ' O ' ' HB2' ' A' ' 43' ' ' ASN . 4.6 tt0 -112.49 -41.36 3.88 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.5 m -59.28 -42.89 92.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.957 0.884 . . . . 0.0 110.584 171.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.586 ' ND2' ' HA ' ' A' ' 39' ' ' ALA . 0.0 OUTLIER -87.8 11.06 16.45 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.885 -175.243 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.593 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 1.8 t-20 -51.55 -34.8 38.13 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.968 -174.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 1.053 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 28.5 t70 -116.13 147.38 41.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.872 0.368 . . . . 0.0 110.997 178.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -40.52 97.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.134 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.28 -29.05 26.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.752 0.311 . . . . 0.0 110.319 -178.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 1.053 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -55.12 -32.94 62.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.574 173.346 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.508 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -65.84 -9.8 32.23 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.443 179.547 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -116.52 -8.89 11.99 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 172.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.595 ' HB2' ' HA ' ' A' ' 47' ' ' LEU . 1.2 tp -84.06 -19.99 33.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.976 0.417 . . . . 0.0 110.964 -176.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.508 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.1 OUTLIER -67.24 -21.61 65.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.415 -179.091 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.13 91.77 0.28 Allowed Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.52 ' H ' HD21 ' A' ' 72' ' ' LEU . . . -58.49 -30.75 67.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.767 0.318 . . . . 0.0 111.757 -174.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -96.14 29.73 9.65 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.694 -179.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.0 mt 61.59 54.95 2.88 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.4 0.619 . . . . 0.0 109.8 -175.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.608 HD22 ' NZ ' ' A' ' 69' ' ' LYS . 0.5 OUTLIER -80.89 -161.97 0.44 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.229 -176.498 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.436 ' H ' ' CG ' ' A' ' 56' ' ' LEU . 7.9 t-20 -133.03 -177.17 4.39 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.234 -174.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -95.52 -144.2 16.24 Favored Glycine 0 C--N 1.314 -0.645 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -176.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.801 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -66.59 155.03 38.94 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 175.074 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.453 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 1.6 t -61.33 100.49 0.13 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.013 0.435 . . . . 0.0 111.322 -178.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.01 -0.4 69.25 Favored Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.142 -179.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.801 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 24.1 t-20 -128.95 97.04 4.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.109 0.481 . . . . 0.0 110.257 -176.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.06 71.09 10.26 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.334 0.588 . . . . 0.0 111.072 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -167.23 -50.92 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.134 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.454 ' OG ' ' HG3' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -89.75 79.87 6.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.139 0.495 . . . . 0.0 109.862 174.312 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.463 ' HB3' HD22 ' A' ' 51' ' ' LEU . . . -86.7 164.19 16.9 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.199 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.789 ' HB2' ' SG ' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -131.86 153.03 50.62 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.578 -179.028 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -116.67 138.74 51.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.244 -178.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.793 ' HE3' HD23 ' A' ' 72' ' ' LEU . 0.0 OUTLIER -88.28 165.45 15.01 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.962 -177.083 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.436 ' HA ' HD12 ' A' ' 73' ' ' ILE . . . -62.33 -25.31 67.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.108 0.48 . . . . 0.0 110.96 -179.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -32.39 70.24 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.441 0.639 . . . . 0.0 109.577 177.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.793 HD23 ' HE3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -73.9 -30.82 62.8 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.574 178.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.436 HD12 ' HA ' ' A' ' 70' ' ' ALA . 3.5 mt -67.87 -35.68 73.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.597 176.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -74.8 -31.43 61.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.933 177.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.08 -52.83 6.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.824 -176.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.535 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 2.8 mm? -105.64 -45.81 4.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.443 -173.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.54 49.59 5.1 Favored Glycine 0 CA--C 1.518 0.279 0 C-N-CA 119.994 -1.098 . . . . 0.0 112.533 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.468 ' HB3' HD11 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -77.59 106.68 9.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.893 0.378 . . . . 0.0 110.978 -179.239 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.621 ' HA ' HG12 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -66.87 -18.29 65.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.938 -177.909 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.73 -21.65 64.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.809 0.337 . . . . 0.0 111.357 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.464 ' CD2' ' HB2' ' A' ' 36' ' ' ASN . 1.9 mt -123.45 28.6 6.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.291 0.567 . . . . 0.0 111.298 -176.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.621 HG12 ' HA ' ' A' ' 79' ' ' LEU . 2.0 p -142.44 145.41 23.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.313 176.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.604 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 9.8 t70 -122.88 171.09 9.47 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.05 177.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.31 80.29 1.79 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.143 0.497 . . . . 0.0 111.223 -174.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.541 HG23 ' H ' ' A' ' 87' ' ' GLU . 1.6 t -78.86 171.81 14.65 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 172.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -51.4 -38.98 56.23 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -176.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.541 ' H ' HG23 ' A' ' 85' ' ' THR . 17.1 mt-10 -88.91 48.35 1.62 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.0 0.429 . . . . 0.0 111.886 -176.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.44 -175.78 49.56 Favored Glycine 0 CA--C 1.522 0.482 0 CA-C-N 115.82 -0.627 . . . . 0.0 113.993 172.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -62.96 138.09 66.14 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.985 2.456 . . . . 0.0 111.547 175.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.453 HG11 ' HB3' ' A' ' 17' ' ' ALA . 0.3 OUTLIER -149.51 173.43 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.152 -172.815 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 14.1 t -67.64 143.3 56.07 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 174.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.604 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 2.8 tttp -78.24 -46.3 20.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.38 -176.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.514 ' HB3' HG13 ' A' ' 94' ' ' ILE . 4.5 m-20 -142.89 -82.14 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.029 0.442 . . . . 0.0 111.948 -172.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.514 HG13 ' HB3' ' A' ' 93' ' ' ASN . 2.1 mt -96.65 130.31 45.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.237 -170.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.3 p -83.42 138.06 19.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.668 0.27 . . . . 0.0 110.371 176.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.41 ' HA ' HG23 ' A' ' 108' ' ' VAL . . . -148.68 164.18 35.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.017 0.437 . . . . 0.0 111.926 -175.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.55 122.28 46.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.314 175.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.789 ' SG ' ' HB2' ' A' ' 67' ' ' CYS . 57.0 m -132.71 127.58 20.49 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.516 -173.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -86.89 178.11 3.8 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.118 1.879 . . . . 0.0 110.965 173.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.458 ' HA ' HD13 ' A' ' 56' ' ' LEU . 1.0 OUTLIER -123.94 157.52 34.12 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 168.99 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 102.26 -45.15 1.4 Allowed Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.865 -178.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.42 HG23 ' OG1' ' A' ' 103' ' ' THR . 10.5 t -177.92 174.97 1.36 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.824 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.6 OUTLIER 68.52 -175.11 0.2 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.594 176.672 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.824 ' H ' HG22 ' A' ' 103' ' ' THR . 0.3 OUTLIER -104.91 -178.9 3.79 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.079 -164.016 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 68.6 m -112.52 143.48 43.6 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.858 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 86.9 t -103.71 113.33 40.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.176 175.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.98 118.32 18.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 174.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.438 ' HB ' HG22 ' A' ' 25' ' ' THR . 0.1 OUTLIER -96.05 17.61 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.806 -170.575 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -115.73 106.34 13.76 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.556 0.693 . . . . 0.0 110.191 174.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -128.56 30.9 5.07 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 114.869 -1.06 . . . . 0.0 108.619 173.13 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -128.45 -39.54 1.67 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.882 -177.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 96.74 86.79 1.8 Allowed Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.359 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -86.84 -151.81 0.17 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.888 0.375 . . . . 0.0 111.008 177.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -102.0 -115.29 3.96 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.642 -0.79 . . . . 0.0 111.557 175.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.532 ' O ' ' HG3' ' A' ' 116' ' ' LYS . 1.7 p -104.64 -36.14 7.57 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 173.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 115' ' ' THR . 2.0 mtmm -158.02 -83.77 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.563 -1.199 . . . . 0.0 108.683 175.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -120.49 78.44 1.37 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 173.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 . . . . . 0 C--O 1.253 1.286 0 CA-C-O 117.774 -1.108 . . . . 0.0 109.973 -177.389 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.775 0 CA-C-O 120.432 0.158 . . . . 0.0 110.613 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.5 145.25 98.94 Favored Pre-proline 0 C--O 1.233 0.211 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.543 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -75.04 64.46 6.08 Favored 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 122.722 2.281 . . . . 0.0 112.693 -178.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.48 -55.72 4.84 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.172 0.511 . . . . 0.0 110.158 178.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.3 -0.39 46.65 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.301 176.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 72.95 -45.63 0.63 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.303 177.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 60.97 47.74 7.2 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.438 0.637 . . . . 0.0 110.684 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.8 mttt -128.17 112.86 14.99 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.042 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.38 -171.9 2.04 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.68 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -98.76 16.11 23.22 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.739 -175.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.9 mtmt -110.27 102.45 11.11 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.46 HD22 ' HB2' ' A' ' 70' ' ' ALA . 0.0 OUTLIER -73.41 86.36 1.52 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.24 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 74.76 -44.47 0.55 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.212 -172.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.437 ' O ' ' HB2' ' A' ' 15' ' ' SER . 0.5 OUTLIER -158.44 -40.16 0.06 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.79 -177.961 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.437 ' HB2' ' O ' ' A' ' 14' ' ' THR . 2.7 m 69.75 -69.32 0.17 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.513 -177.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 47.26 -92.58 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.475 0.71 . . . . 0.0 112.154 178.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.521 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . . . -62.9 -30.53 71.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.191 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.63 ' HB2' HG12 ' A' ' 90' ' ' VAL . 15.3 t80 -67.12 -27.6 67.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 110.305 177.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.87 -20.85 60.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.539 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.521 ' HD3' ' HA ' ' A' ' 17' ' ' ALA . 5.0 mtpp -71.83 -26.84 62.54 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.569 ' HG3' ' HA ' ' A' ' 116' ' ' LYS . 0.0 OUTLIER -86.34 -36.57 19.16 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 113.893 -1.503 . . . . 0.0 110.541 179.29 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.67 -14.0 61.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.055 -174.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -109.15 16.77 22.25 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.445 0.641 . . . . 0.0 110.442 175.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -115.86 -27.67 2.92 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.22 174.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.67 142.22 34.71 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -91.12 96.7 10.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.932 0.396 . . . . 0.0 110.741 178.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.444 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 81.6 m -148.92 -179.04 6.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -98.73 159.87 14.66 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.425 ' H ' HG22 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -64.12 -49.48 81.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 120.798 0.332 . . . . 0.0 111.581 -178.113 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.21 -27.67 57.46 Favored Glycine 0 CA--C 1.509 -0.3 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.803 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -100.77 46.17 0.95 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.717 0.294 . . . . 0.0 111.218 -175.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.3 tt -112.32 138.84 39.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 174.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.405 ' HA ' ' HA ' ' A' ' 69' ' ' LYS . . . -146.54 155.32 42.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.536 0.684 . . . . 0.0 112.626 -171.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.6 m -109.88 133.23 53.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.637 174.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.41 ' HA ' HD22 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -123.13 165.13 17.36 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.6 -178.387 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.421 ' HB3' ' OG1' ' A' ' 41' ' ' THR . 3.2 t30 -149.29 161.16 42.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.71 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -49.02 127.36 14.73 Favored Pre-proline 0 C--O 1.237 0.398 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.572 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.465 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 31.4 Cg_exo -47.93 -47.45 18.93 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 123.815 3.01 . . . . 0.0 113.925 -178.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.51 -20.58 56.49 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -173.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -102.91 -48.57 4.03 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.033 0.444 . . . . 0.0 109.839 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.448 HG21 HD21 ' A' ' 81' ' ' LEU . 88.1 m -59.31 -35.95 74.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.564 177.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.4 m-80 -103.88 14.69 30.29 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.316 -173.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -69.08 -21.64 64.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.217 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.928 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.0 t70 -103.66 152.76 21.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.495 179.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.91 -29.41 44.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.743 0.306 . . . . 0.0 111.441 -177.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.469 ' HG ' HD13 ' A' ' 50' ' ' LEU . 9.6 tp -90.03 -36.98 14.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.698 0.285 . . . . 0.0 110.493 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.928 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.4 OUTLIER -50.47 -38.69 45.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.67 178.058 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.424 ' HA ' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -63.97 -28.18 69.64 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.573 -176.349 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -95.31 -25.1 14.66 Favored Glycine 0 C--N 1.33 0.207 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.626 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.557 ' HB3' HD21 ' A' ' 78' ' ' LEU . 1.2 tp -63.64 -32.89 74.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.969 0.414 . . . . 0.0 110.623 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 47' ' ' LEU . 7.6 mt -60.53 -39.89 89.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.631 177.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.694 ' HA2' ' HG ' ' A' ' 56' ' ' LEU . . . -87.08 67.6 3.34 Favored Glycine 0 N--CA 1.443 -0.865 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.654 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -68.5 -23.85 64.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.435 0.636 . . . . 0.0 110.437 -176.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -124.55 25.66 5.89 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.046 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 63.74 39.26 8.65 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.471 0.653 . . . . 0.0 109.86 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.694 ' HG ' ' HA2' ' A' ' 52' ' ' GLY . 0.7 OUTLIER -80.32 179.66 7.57 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.038 177.392 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.936 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 7.9 t-20 -118.75 -177.27 3.27 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.37 -175.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -97.93 -143.06 14.1 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.453 -176.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.553 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -65.54 148.89 50.97 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 178.957 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.569 ' HA ' ' HB2' ' A' ' 104' ' ' ASN . 0.1 OUTLIER -57.24 90.28 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.64 -178.684 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.78 -10.34 70.54 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.86 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.553 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 57.9 t30 -117.55 105.93 12.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.284 0.564 . . . . 0.0 111.72 -174.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.44 131.5 42.65 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.359 178.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.48 -56.44 0.73 Allowed Glycine 0 CA--C 1.509 -0.325 0 C-N-CA 121.1 -0.571 . . . . 0.0 111.954 177.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.2 90.97 4.92 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.97 0.414 . . . . 0.0 110.42 178.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.02 160.74 16.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.079 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 64.7 m -126.55 130.84 51.34 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.061 0.457 . . . . 0.0 110.994 -178.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -105.49 125.83 51.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.578 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.452 ' NZ ' ' HA ' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -82.66 167.47 18.22 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.771 -178.555 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.46 ' HB2' HD22 ' A' ' 12' ' ' LEU . . . -60.55 -30.28 69.68 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.301 0.572 . . . . 0.0 109.997 175.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -23.12 63.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.511 176.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.823 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 1.3 tp -87.65 -24.03 24.05 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.501 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -60.29 -38.01 75.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -90.52 -5.11 56.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.408 0.623 . . . . 0.0 110.704 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.823 ' HB2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -87.38 -54.16 4.44 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.138 -176.798 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.486 ' HA ' HD13 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -126.73 -9.91 6.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.509 -176.495 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 67.33 47.93 60.92 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.407 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.557 HD21 ' HB3' ' A' ' 50' ' ' LEU . 65.6 mt -71.19 129.91 40.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.653 0.263 . . . . 0.0 111.264 -178.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.63 4.16 19.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.093 177.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.49 -29.56 62.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.098 -174.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.448 HD21 HG21 ' A' ' 41' ' ' THR . 0.0 OUTLIER -128.89 4.92 5.4 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.973 0.416 . . . . 0.0 111.355 -174.666 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 6.2 t -111.11 137.66 42.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.885 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.904 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 6.9 t0 -115.47 154.61 28.99 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.7 m80 -125.87 114.6 18.76 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.316 0.579 . . . . 0.0 110.179 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.07 -169.96 1.56 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.143 -177.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -72.63 -19.75 61.39 Favored 'General case' 0 C--N 1.323 -0.57 0 O-C-N 123.335 0.397 . . . . 0.0 111.0 -178.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -89.14 -14.05 37.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.01 177.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 128.85 -152.79 19.47 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.635 -0.793 . . . . 0.0 113.516 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -79.51 129.59 8.49 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 123.321 2.68 . . . . 0.0 111.91 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.925 HG11 ' HD3' ' A' ' 116' ' ' LYS . 3.1 m -149.55 -178.56 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.237 -175.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.92 133.7 43.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.237 177.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.904 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 8.1 tttp -74.98 -49.92 18.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.545 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -136.84 -74.91 0.42 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.149 -172.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.0 mt -98.93 138.63 22.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.602 -171.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.4 p -112.27 138.93 39.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.478 ' CB ' ' HA ' ' A' ' 107' ' ' ALA . . . -150.2 168.93 22.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.05 0.452 . . . . 0.0 111.867 -176.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.444 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -112.03 117.17 31.95 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 171.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.479 ' HA ' ' HB3' ' A' ' 105' ' ' CYS . 44.5 t -138.69 139.76 25.31 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.673 0.273 . . . . 0.0 111.735 -170.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -82.86 -178.42 3.88 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 123.35 2.7 . . . . 0.0 112.093 176.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.452 ' HA ' ' NZ ' ' A' ' 69' ' ' LYS . 3.2 tp10 -80.18 -30.63 38.82 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -177.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.594 ' HA2' ' HA ' ' A' ' 56' ' ' LEU . . . -178.82 64.56 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 119.532 -1.318 . . . . 0.0 113.202 -178.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -153.94 108.54 3.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.601 0.239 . . . . 0.0 110.471 175.084 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 54.61 -176.25 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.669 0.747 . . . . 0.0 112.52 -178.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.936 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -74.42 165.44 25.19 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.734 -178.009 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.479 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 2.5 m -111.03 143.16 42.16 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.002 -175.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.0 p -85.35 120.79 36.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.125 0.488 . . . . 0.0 111.254 -176.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.529 ' HB3' HD11 ' A' ' 59' ' ' LEU . . . -96.88 125.76 41.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.144 175.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -89.38 10.52 2.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.109 0.48 . . . . 0.0 110.945 -178.173 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.504 ' O ' ' HB3' ' A' ' 110' ' ' ASN . 21.2 t0 -74.39 139.22 43.9 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.306 179.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.504 ' HB3' ' O ' ' A' ' 109' ' ' ASP . 3.9 p30 168.13 -14.47 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.301 1.001 . . . . 0.0 109.306 -176.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -71.36 -44.57 64.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.414 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 112.7 114.19 3.27 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.478 -0.868 . . . . 0.0 112.492 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . 62.27 53.14 2.91 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.256 0.551 . . . . 0.0 111.139 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -109.07 65.9 0.24 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.417 -0.897 . . . . 0.0 113.234 -177.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.45 -44.34 11.4 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 176.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.925 ' HD3' HG11 ' A' ' 90' ' ' VAL . 7.4 mtmt -151.52 147.49 26.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.56 178.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -79.65 121.84 25.8 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 173.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.77 -0.633 . . . . 0.0 110.881 -176.784 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -126.78 144.91 51.65 Favored Pre-proline 0 C--N 1.327 -0.395 0 O-C-N 122.309 -0.244 . . . . 0.0 110.764 -177.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -66.06 -17.06 54.49 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 122.565 2.177 . . . . 0.0 112.466 177.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 59.27 34.4 23.0 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.929 175.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 29.5 m 69.95 7.3 6.16 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 178.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.04 -63.65 1.06 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 176.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -80.03 124.38 28.67 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 170.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.4 43.31 2.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.133 0.492 . . . . 0.0 110.833 -174.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -136.83 135.67 38.14 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.742 179.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -139.78 50.13 1.76 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.013 0.435 . . . . 0.0 110.705 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -119.72 177.8 4.82 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.7 177.362 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.614 ' HG ' ' CD2' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -80.66 57.79 3.06 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 173.325 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 70.88 -53.42 0.67 Allowed 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.59 0.756 . . . . 0.0 109.752 -167.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.61 -34.12 0.19 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.344 175.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.526 ' CB ' ' HB2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER 62.53 32.34 16.57 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.398 -0.819 . . . . 0.0 112.096 175.467 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.1 -37.92 84.76 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.136 0.493 . . . . 0.0 110.073 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.37 -33.63 19.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.552 177.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.614 ' CD2' ' HG ' ' A' ' 12' ' ' LEU . 87.7 t80 -69.66 -44.35 70.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.453 -177.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.44 0.67 0.66 Allowed 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.682 ' HB3' ' HB ' ' A' ' 115' ' ' THR . 0.0 OUTLIER -73.37 -5.89 42.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.623 0.725 . . . . 0.0 109.112 176.178 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.556 ' HB3' HD11 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -82.88 -8.82 59.54 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.377 176.97 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -109.11 3.76 22.29 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.757 175.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.47 ' OE1' ' HG3' ' A' ' 20' ' ' LYS . 41.6 mt-10 -115.68 -75.97 0.58 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.734 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -70.07 -42.52 67.62 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.893 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.472 ' OG1' ' HA ' ' A' ' 21' ' ' GLN . 0.2 OUTLIER -83.82 132.05 34.84 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.397 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.88 95.32 7.3 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.232 0.539 . . . . 0.0 110.681 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 60.7 m -144.56 -178.32 5.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.256 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -110.84 148.36 32.57 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.9 t -66.87 -47.43 82.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.912 0.387 . . . . 0.0 110.744 -177.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.73 18.51 5.81 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.322 177.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -152.42 38.0 0.54 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.556 HD11 ' HB3' ' A' ' 21' ' ' GLN . 0.2 OUTLIER -96.57 136.56 27.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.087 -178.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.477 ' HB2' ' HB3' ' A' ' 98' ' ' CYS . . . -149.53 -179.72 7.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.18 0.514 . . . . 0.0 112.204 -175.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.549 ' SG ' ' HE1' ' A' ' 18' ' ' PHE . 64.8 m -131.81 144.82 51.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.814 175.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.443 ' HA ' ' HG ' ' A' ' 81' ' ' LEU . 0.9 OUTLIER -134.72 165.08 26.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.645 0.26 . . . . 0.0 110.568 -176.105 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.461 ' CB ' HD12 ' A' ' 81' ' ' LEU . 33.7 t-20 -154.08 161.16 42.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.258 177.69 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.5 m -53.99 146.92 26.79 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.139 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.428 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 46.4 Cg_exo -56.58 -33.74 93.75 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 123.05 2.5 . . . . 0.0 113.004 -175.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.05 -14.87 63.32 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.61 -48.7 3.37 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.311 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.72 ' HA ' ' HB1' ' A' ' 80' ' ' ALA . 3.1 m -56.29 -36.28 68.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.468 178.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.8 m-80 -105.58 14.23 28.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.847 -174.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -62.53 -26.49 68.59 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.952 0.406 . . . . 0.0 111.178 -175.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.829 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 8.0 t70 -119.02 146.16 45.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.683 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -24.85 62.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.105 0.479 . . . . 0.0 111.122 -179.342 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.2 tp -90.83 -23.58 20.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.104 177.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.829 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.7 OUTLIER -60.01 -45.92 91.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.876 179.99 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.8 -32.87 74.64 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.931 -178.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -75.86 -22.3 74.78 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 121.011 -0.614 . . . . 0.0 111.778 176.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.574 ' HG ' ' HB3' ' A' ' 76' ' ' LEU . 0.7 OUTLIER -75.44 -26.17 58.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.038 0.447 . . . . 0.0 109.855 177.881 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.747 HD11 HD21 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -67.33 -40.33 85.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.716 179.139 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.66 72.19 1.72 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.336 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.37 -17.04 61.86 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.165 0.507 . . . . 0.0 110.312 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.24 47.46 0.8 Allowed Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.619 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.9 mt 55.39 51.79 12.38 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.181 0.515 . . . . 0.0 110.743 -177.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.726 HD21 ' H ' ' A' ' 101' ' ' GLY . 12.8 mt -88.84 172.27 9.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.887 -177.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.504 ' HB2' ' C ' ' A' ' 103' ' ' THR . 4.3 m-20 -114.59 -178.39 3.36 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.378 174.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -99.46 -131.88 7.49 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.346 -0.93 . . . . 0.0 111.025 178.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.827 ' HB3' ' HB3' ' A' ' 62' ' ' ASN . 0.3 OUTLIER -67.92 155.89 38.41 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 171.339 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.402 ' HA ' ' CG ' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -52.24 105.7 0.12 Allowed 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 120.84 0.352 . . . . 0.0 111.148 -178.128 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.14 33.26 85.27 Favored Glycine 0 C--N 1.335 0.506 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.414 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.827 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 25.1 t-20 -126.08 100.9 6.54 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.904 0.383 . . . . 0.0 110.399 -176.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.45 77.56 9.21 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.085 0.469 . . . . 0.0 111.105 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.07 -55.62 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.91 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.6 m -88.66 129.59 35.48 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 176.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.643 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . . . -131.82 153.96 49.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.592 0.234 . . . . 0.0 110.423 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.695 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 0.8 OUTLIER -118.09 135.55 54.13 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.272 0.558 . . . . 0.0 111.201 -174.343 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.406 ' CB ' HD23 ' A' ' 81' ' ' LEU . . . -105.71 146.52 29.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.294 177.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.517 ' HE3' ' HG2' ' A' ' 100' ' ' GLU . 1.6 mppt? -102.36 168.33 9.39 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.36 -36.14 77.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.019 0.437 . . . . 0.0 110.809 178.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.612 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -62.85 -27.7 69.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.517 176.861 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.572 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 4.0 mp -82.21 -25.55 34.1 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.709 -178.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.23 -36.68 77.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.045 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -100.05 4.08 44.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.767 177.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.612 ' HB2' ' O ' ' A' ' 71' ' ' SER . 1.0 OUTLIER -94.92 -53.89 3.67 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.114 -178.783 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.574 ' HB3' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -123.89 -30.98 3.46 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.964 -175.522 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.94 50.76 3.19 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.02 -1.086 . . . . 0.0 112.0 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.438 ' CD1' ' HB3' ' A' ' 50' ' ' LEU . 3.7 mm? -57.44 113.08 1.62 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.754 0.312 . . . . 0.0 110.976 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -97.27 6.32 48.57 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.189 -177.896 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.72 ' HB1' ' HA ' ' A' ' 41' ' ' THR . . . -89.37 -40.84 12.48 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -175.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.747 HD21 HD11 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -99.21 -4.68 31.47 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.728 -171.749 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 2.8 t -108.86 137.94 38.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.875 0.369 . . . . 0.0 111.023 -174.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.716 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 27.7 t0 -120.29 174.42 6.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.108 179.204 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 27.1 p80 -60.11 140.51 56.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.115 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.483 ' HB ' HG22 ' A' ' 90' ' ' VAL . 5.3 t -143.14 160.68 39.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.852 -177.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -115.29 16.18 16.85 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.436 0.636 . . . . 0.0 109.71 176.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.44 ' HB3' ' H ' ' A' ' 88' ' ' GLY . 6.4 tm-20 -139.8 -93.48 0.17 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.42 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.534 ' O ' HG13 ' A' ' 90' ' ' VAL . . . -122.62 160.35 17.1 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 175.127 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.511 ' O ' HD12 ' A' ' 12' ' ' LEU . 51.3 Cg_exo -52.21 128.84 28.8 Favored 'Trans proline' 0 N--CA 1.474 0.326 0 C-N-CA 122.791 2.328 . . . . 0.0 112.259 -176.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 88' ' ' GLY . 29.0 m -125.16 159.72 31.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.946 -175.234 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.4 m -66.84 142.52 57.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.066 0.46 . . . . 0.0 111.227 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.716 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 2.0 tttp -75.43 -37.92 60.1 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.692 -176.515 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 12.1 m-20 -146.63 -72.13 0.23 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.27 -0.423 . . . . 0.0 112.015 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.42 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 74.7 mt -86.87 126.68 40.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.566 -171.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 27.4 m -92.93 128.91 44.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.404 174.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.509 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . . . -154.84 156.68 36.64 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.796 0.331 . . . . 0.0 111.097 -176.206 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.58 131.27 53.18 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 174.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.51 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 28.3 t -143.73 134.86 12.54 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.154 -172.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -85.26 155.8 10.97 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 122.488 2.126 . . . . 0.0 111.838 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.517 ' HG2' ' HE3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -100.55 127.63 46.86 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 176.221 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.726 ' H ' HD21 ' A' ' 56' ' ' LEU . . . 100.41 -7.7 58.3 Favored Glycine 0 N--CA 1.44 -1.077 0 C-N-CA 120.745 -0.74 . . . . 0.0 113.379 176.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.76 121.15 10.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -172.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.504 ' C ' ' HB2' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 41.52 -135.11 0.28 Allowed 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.876 1.435 . . . . 0.0 114.876 168.708 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.469 ' H ' ' HB ' ' A' ' 103' ' ' THR . 0.3 OUTLIER -111.83 179.57 3.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.558 0.694 . . . . 0.0 112.599 -164.237 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.695 ' SG ' ' HB2' ' A' ' 67' ' ' CYS . 0.0 OUTLIER -118.47 154.98 31.6 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.735 -1.12 . . . . 0.0 111.052 -176.727 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 2.3 m -103.76 137.92 30.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.348 178.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -104.57 142.04 35.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.087 -176.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -122.62 20.6 4.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.294 0.568 . . . . 0.0 111.21 -178.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -90.32 21.14 3.99 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.86 -178.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -77.36 -5.67 50.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.331 -178.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -135.32 170.85 15.3 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.228 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -84.1 62.37 4.59 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.004 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -140.12 92.38 2.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.056 0.455 . . . . 0.0 111.196 -178.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -132.89 116.04 1.69 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.615 -0.802 . . . . 0.0 111.869 178.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.682 ' HB ' ' HB3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -86.07 59.8 5.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.825 0.312 . . . . 0.0 111.223 -176.615 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 115' ' ' THR . 0.0 OUTLIER -175.85 25.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.104 175.3 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 118' ' ' GLU . . . -84.86 78.72 9.84 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.274 -177.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' A' ' 117' ' ' ALA . 15.6 mt-10 . . . . . 0 C--O 1.25 1.11 0 O-C-N 124.041 0.838 . . . . 0.0 111.288 178.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.086 0 CA-C-O 120.966 0.412 . . . . 0.0 110.516 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' A' ' 2' ' ' LEU . 0.0 OUTLIER -113.36 143.73 29.88 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 177.793 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -62.49 99.28 0.2 Allowed 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.676 2.251 . . . . 0.0 112.131 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -112.48 -128.01 0.29 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.031 177.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.2 -56.3 3.52 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.762 0.315 . . . . 0.0 110.512 177.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -156.75 172.26 18.92 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.225 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -108.1 161.12 15.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.953 0.406 . . . . 0.0 111.036 -178.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.5 107.6 13.44 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.889 -177.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -100.42 8.29 43.69 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.525 -177.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -87.17 -19.95 27.7 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.426 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.4 mmtp -132.5 145.22 51.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.923 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.61 ' HG ' ' OG ' ' A' ' 15' ' ' SER . 0.1 OUTLIER -104.3 90.59 3.6 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.097 178.162 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.436 ' O ' ' HB ' ' A' ' 14' ' ' THR . . . 60.69 60.4 1.93 Allowed 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.551 177.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.436 ' HB ' ' O ' ' A' ' 13' ' ' ALA . 87.5 m 76.68 -48.9 0.56 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.412 -178.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.658 ' HB3' ' HB3' ' A' ' 18' ' ' PHE . 20.2 m 57.29 41.25 26.97 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.141 0.276 . . . . 0.0 111.108 179.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.574 ' HB3' ' HB3' ' A' ' 87' ' ' GLU . . . -55.38 -50.14 70.49 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.771 0.319 . . . . 0.0 111.348 -173.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.84 ' HB1' ' HG3' ' A' ' 116' ' ' LYS . . . -93.61 -19.09 21.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.956 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.658 ' HB3' ' HB3' ' A' ' 15' ' ' SER . 19.9 t80 -70.13 -24.57 63.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.963 0.411 . . . . 0.0 110.089 177.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.96 -37.21 86.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.706 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.19 -33.4 71.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.519 0.676 . . . . 0.0 109.323 177.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.85 -39.05 80.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.475 176.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.43 -16.06 63.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.748 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -101.96 0.89 36.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.816 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.9 -32.43 63.65 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.913 -0.66 . . . . 0.0 111.94 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.04 158.89 44.07 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 177.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.52 95.3 1.78 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.214 0.531 . . . . 0.0 111.592 -176.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.1 m -148.24 150.36 33.55 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.123 176.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.44 -164.93 2.14 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 p -57.17 127.55 16.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.142 0.496 . . . . 0.0 110.5 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.537 ' O ' ' HA ' ' A' ' 99' ' ' PRO . . . 106.37 -30.46 9.53 Favored Glycine 0 N--CA 1.445 -0.743 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.177 -178.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.6 p -124.02 -11.17 7.61 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.6 tt -83.06 125.8 40.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.408 0.623 . . . . 0.0 110.751 -177.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.49 178.27 9.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.063 -179.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 12.2 m -125.8 137.84 53.8 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.221 173.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.493 ' C ' HD21 ' A' ' 81' ' ' LEU . 1.2 m -113.13 156.01 23.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.749 0.309 . . . . 0.0 110.824 -176.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.567 ' HB2' ' CD2' ' A' ' 81' ' ' LEU . 16.6 t-20 -141.52 159.39 42.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.959 0.409 . . . . 0.0 111.276 -177.021 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.78 138.52 95.37 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.998 175.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.557 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 11.9 Cg_endo -55.01 -34.61 87.61 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.006 2.471 . . . . 0.0 112.798 -175.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.8 -8.3 42.08 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.048 0.451 . . . . 0.0 111.61 -178.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -108.25 -50.28 3.06 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.849 HG22 HD21 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -61.57 -35.06 76.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.99 -1.004 . . . . 0.0 111.668 -179.658 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.557 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.7 m-80 -104.11 15.49 28.33 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.644 -172.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -58.91 -28.37 66.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.203 -177.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.935 ' HB3' ' HG ' ' A' ' 47' ' ' LEU . 15.0 t70 -122.52 146.16 47.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.191 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -22.33 62.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.815 -178.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.9 tp -90.38 -27.63 19.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.675 0.274 . . . . 0.0 110.299 178.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.935 ' HG ' ' HB3' ' A' ' 44' ' ' ASP . 19.2 mt -58.77 -40.6 84.4 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.643 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.87 -24.53 67.56 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.089 -178.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -91.55 -18.03 46.79 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.073 -0.584 . . . . 0.0 111.889 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.93 -18.14 48.13 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.166 0.508 . . . . 0.0 110.024 177.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.849 HD21 HG22 ' A' ' 41' ' ' THR . 0.1 OUTLIER -67.45 -43.19 81.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.696 176.847 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -104.16 86.85 0.53 Allowed Glycine 0 N--CA 1.442 -0.95 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.881 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.4 64.62 5.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.402 0.62 . . . . 0.0 109.559 174.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.36 -121.37 2.97 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 -175.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.659 ' HB3' HG23 ' A' ' 102' ' ' THR . 2.1 mt -111.92 47.59 1.04 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.069 0.462 . . . . 0.0 111.156 178.639 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.66 143.52 29.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.229 178.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -117.46 -177.56 3.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.711 -176.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -106.35 -142.42 10.84 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.599 -173.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.444 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -66.86 154.28 41.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.887 0.375 . . . . 0.0 111.14 -179.816 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.0 p -67.93 89.4 0.28 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.905 177.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.87 -45.07 1.47 Allowed Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 116.053 -0.522 . . . . 0.0 112.521 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.48 113.36 12.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.992 0.425 . . . . 0.0 111.064 -177.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.51 114.72 21.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.752 178.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 137.74 -53.08 0.73 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.754 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.53 136.58 44.08 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 176.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.513 ' HB3' HG21 ' A' ' 41' ' ' THR . . . -129.78 167.37 18.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.554 -178.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.463 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -125.43 130.14 51.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.188 178.5 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.407 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -105.34 136.23 45.27 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.795 0.331 . . . . 0.0 110.117 -178.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.457 ' HE2' ' HG3' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -100.99 155.73 17.81 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.094 -177.825 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.414 ' CB ' HD22 ' A' ' 12' ' ' LEU . . . -65.97 -23.61 66.63 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.122 -178.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -27.15 56.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.91 0.862 . . . . 0.0 109.17 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.6 -25.1 21.49 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.303 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.472 ' HA ' ' HB2' ' A' ' 78' ' ' LEU . 0.8 OUTLIER -63.2 -39.83 86.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.959 179.062 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -78.73 -2.99 42.01 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.17 0.51 . . . . 0.0 110.987 178.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.415 ' HB3' HD12 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -81.37 -39.16 25.45 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.724 -173.883 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.415 HD12 ' HB3' ' A' ' 75' ' ' GLN . 1.2 mp -143.84 14.81 1.73 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.707 -176.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.61 44.18 96.88 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.329 -0.939 . . . . 0.0 111.094 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.472 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 3.8 mp -53.47 126.41 21.36 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.183 -0.508 . . . . 0.0 111.143 -176.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.36 -1.8 11.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.772 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.702 ' HB2' HD22 ' A' ' 47' ' ' LEU . . . -79.78 -4.48 52.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.983 -174.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.567 ' CD2' ' HB2' ' A' ' 36' ' ' ASN . 0.3 OUTLIER -155.05 36.37 0.39 Allowed 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -172.955 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.15 137.96 37.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 120.999 0.428 . . . . 0.0 110.327 175.079 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.947 ' HB2' ' HA ' ' A' ' 92' ' ' LYS . 2.3 t0 -109.29 158.5 17.8 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 173.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -124.43 114.96 20.18 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 119.653 -0.819 . . . . 0.0 112.725 -170.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -107.95 -169.95 1.6 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.732 171.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -81.68 -7.62 59.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.72 0.295 . . . . 0.0 111.581 -175.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.574 ' HB3' ' HB3' ' A' ' 16' ' ' ALA . 0.3 OUTLIER -104.43 12.95 32.76 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 120.862 0.363 . . . . 0.0 110.782 -178.154 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 115.42 -166.43 12.22 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.602 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -80.07 136.05 11.41 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 123.369 2.713 . . . . 0.0 111.323 176.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.709 HG21 ' HE2' ' A' ' 116' ' ' LYS . 0.3 OUTLIER -140.29 -170.76 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.289 -175.251 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -66.49 132.0 47.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.09 0.472 . . . . 0.0 110.802 -177.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.947 ' HA ' ' HB2' ' A' ' 83' ' ' ASP . 6.3 tptp -74.7 -35.29 62.74 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.408 -175.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -155.34 -74.34 0.11 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.603 -175.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.6 mp -98.89 138.11 24.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.39 -172.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 25.7 t -97.28 118.47 43.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.945 178.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -144.03 160.67 40.47 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.745 0.307 . . . . 0.0 110.99 -176.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.13 124.8 50.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.497 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 45.9 t -136.0 117.85 11.89 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.971 -172.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.537 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 89.2 Cg_endo -76.14 138.27 20.18 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 122.863 2.375 . . . . 0.0 112.058 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.457 ' HG3' ' HE2' ' A' ' 69' ' ' LYS . 3.8 tt0 -85.91 139.33 31.33 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.54 176.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 128.62 -63.41 0.62 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.976 -0.63 . . . . 0.0 111.55 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.659 HG23 ' HB3' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -167.28 176.18 6.88 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 122.635 0.374 . . . . 0.0 110.196 178.378 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.537 HG22 ' H ' ' A' ' 104' ' ' ASN . 0.7 OUTLIER 73.84 166.11 0.29 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.672 0.749 . . . . 0.0 112.158 177.407 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.537 ' H ' HG22 ' A' ' 103' ' ' THR . 21.5 m-20 -79.01 173.18 12.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.644 -1.162 . . . . 0.0 112.224 -174.129 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.497 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -113.27 142.94 45.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.744 175.381 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -102.91 142.01 17.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.066 0.46 . . . . 0.0 111.215 -175.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -106.86 122.84 47.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.339 177.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.33 17.59 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.931 -177.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -86.42 -42.98 13.17 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.834 -178.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 64.57 25.32 13.17 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.906 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 63.29 172.94 0.16 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.547 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -175.04 -116.44 0.44 Allowed Glycine 0 N--CA 1.443 -0.871 0 N-CA-C 110.794 -0.922 . . . . 0.0 110.794 176.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -160.15 -29.44 0.06 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.867 0.365 . . . . 0.0 111.037 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -86.82 134.78 12.75 Favored Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 178.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' A' ' 116' ' ' LYS . 0.7 OUTLIER -88.7 -43.93 10.95 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.952 0.406 . . . . 0.0 111.123 -176.948 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.84 ' HG3' ' HB1' ' A' ' 17' ' ' ALA . 0.0 OUTLIER 171.71 -25.63 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.596 -175.433 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -86.03 78.05 9.51 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.404 0.621 . . . . 0.0 111.089 -177.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 . . . . . 0 C--O 1.245 0.824 0 CA-C-O 118.266 -0.873 . . . . 0.0 108.804 175.674 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 120.564 0.221 . . . . 0.0 110.679 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.01 163.26 58.71 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.353 179.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.31 95.63 0.1 Allowed 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.899 2.4 . . . . 0.0 112.426 176.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -153.69 -119.79 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.881 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -27.98 63.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.15 0.5 . . . . 0.0 110.945 178.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.99 63.66 5.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.468 -178.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -123.41 25.23 8.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.581 176.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.5 mmpt? -117.01 117.19 28.96 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.789 -176.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -113.01 13.96 19.56 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.531 -176.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -97.81 103.82 15.79 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.121 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.2 mmtt -128.61 -179.12 4.88 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.941 0.4 . . . . 0.0 110.548 -177.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.47 ' C ' ' H ' ' A' ' 14' ' ' THR . 3.8 mp -92.51 44.36 1.16 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.39 -179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 69.48 -13.63 0.37 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.716 0.806 . . . . 0.0 111.888 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.47 ' H ' ' C ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -164.26 -55.3 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 177.705 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.508 ' HB2' ' H ' ' A' ' 16' ' ' ALA . 0.3 OUTLIER 56.7 -96.69 0.07 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.991 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.508 ' H ' ' HB2' ' A' ' 15' ' ' SER . . . 53.46 -91.97 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.66 0.6 . . . . 0.0 111.507 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.599 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . . . -53.85 -38.78 65.02 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.059 0.457 . . . . 0.0 110.871 174.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.713 ' HA ' ' HD2' ' A' ' 116' ' ' LYS . 65.5 t80 -73.5 -35.18 65.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.539 177.43 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 23' ' ' GLU . . . -65.16 -21.06 66.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.577 -174.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.599 ' HE3' ' HA ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -52.4 -24.43 7.73 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.943 0.401 . . . . 0.0 111.115 177.033 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.497 ' HG3' ' HE3' ' A' ' 116' ' ' LYS . 1.0 OUTLIER -64.93 -31.49 72.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.918 179.088 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -90.46 -17.25 27.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.21 -176.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.506 ' HG3' ' HA ' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -97.26 -45.31 6.55 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.871 -179.26 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.57 -37.07 21.42 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.377 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.94 153.43 28.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.871 0.367 . . . . 0.0 111.025 -177.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.66 98.35 11.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.999 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.2 m -135.5 170.8 15.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.746 176.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.418 ' H ' ' HB2' ' A' ' 31' ' ' SER . 2.2 t-20 -111.16 164.83 12.45 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.053 -173.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -61.06 -35.52 65.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.243 -178.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -107.14 35.97 4.69 Favored Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 176.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.756 ' HA ' ' O ' ' A' ' 98' ' ' CYS . 15.6 m -145.84 -9.29 0.54 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.409 -0.395 . . . . 0.0 111.263 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -81.18 126.11 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.12 -179.33 6.95 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.336 0.589 . . . . 0.0 112.061 -169.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.433 ' O ' HD13 ' A' ' 81' ' ' LEU . 7.8 t -136.86 141.07 42.78 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.124 172.508 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -122.61 151.66 41.23 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.082 -178.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -135.71 157.05 47.81 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.66 135.54 7.8 Favored Pre-proline 0 C--N 1.33 -0.252 0 O-C-N 124.05 0.843 . . . . 0.0 110.922 177.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -49.91 -38.68 48.78 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.589 2.859 . . . . 0.0 113.609 -174.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.45 -8.86 54.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.973 0.416 . . . . 0.0 111.663 -177.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -109.13 -35.37 6.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.143 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -42.22 81.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.611 0.72 . . . . 0.0 110.259 175.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -95.27 15.46 19.22 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.531 -178.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -58.72 -32.3 69.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.886 178.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.993 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 24.7 t70 -108.4 136.1 48.6 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.672 174.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -25.28 65.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.733 0.301 . . . . 0.0 111.573 -176.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.3 tp -91.78 -22.85 19.94 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.956 178.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.993 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.1 OUTLIER -55.92 -46.45 78.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.273 -178.362 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.568 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -61.8 -24.2 66.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.039 0.447 . . . . 0.0 111.358 -179.261 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -96.03 -5.89 59.37 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.579 -0.819 . . . . 0.0 111.74 177.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.806 ' HG ' ' HG ' ' A' ' 76' ' ' LEU . 1.3 tp -83.96 -33.52 24.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.826 0.346 . . . . 0.0 110.194 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.568 HD21 ' HA ' ' A' ' 48' ' ' SER . 0.3 OUTLIER -73.86 -32.54 63.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.362 178.334 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.659 ' HA2' ' HB2' ' A' ' 56' ' ' LEU . . . -84.9 69.04 3.39 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.551 -0.833 . . . . 0.0 111.996 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.27 55.46 2.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.419 0.628 . . . . 0.0 109.812 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 141.27 -112.42 0.77 Allowed Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.611 -0.996 . . . . 0.0 110.611 -175.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.72 60.29 1.03 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.159 0.504 . . . . 0.0 110.215 175.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.659 ' HB2' ' HA2' ' A' ' 52' ' ' GLY . 0.2 OUTLIER -87.08 142.13 28.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.165 178.768 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.564 ' HB3' ' HA ' ' A' ' 104' ' ' ASN . 1.0 OUTLIER -111.59 -178.0 3.33 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.382 -176.742 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -109.84 -155.12 15.34 Favored Glycine 0 C--O 1.227 -0.305 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.148 -175.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.483 HD22 ' HA ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -65.7 146.45 54.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.794 0.33 . . . . 0.0 110.64 176.838 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.9 m -66.09 93.15 0.19 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.778 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 109.83 -58.87 0.37 Allowed Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.868 -178.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -71.71 99.43 2.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.034 0.445 . . . . 0.0 110.615 -179.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.73 70.27 8.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.394 0.616 . . . . 0.0 110.586 179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -166.72 -54.47 0.03 OUTLIER Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.536 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.69 120.28 14.43 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 175.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.507 ' HB1' HD13 ' A' ' 51' ' ' LEU . . . -115.74 142.16 47.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.559 -178.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.497 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 1.0 OUTLIER -110.98 128.95 56.01 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.593 -178.407 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 1.036 ' HB3' HD11 ' A' ' 81' ' ' LEU . . . -111.63 140.5 46.2 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.013 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.719 ' HD2' ' HB3' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -94.69 174.65 7.0 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.32 -174.733 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.26 -31.36 71.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.104 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.474 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.9 OUTLIER -67.13 -36.31 81.62 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.702 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.527 HD13 ' HA ' ' A' ' 72' ' ' LEU . 0.1 OUTLIER -75.24 -36.16 61.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.494 178.788 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.8 mt -61.51 -41.73 91.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.295 0.569 . . . . 0.0 109.641 175.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -77.22 -7.36 55.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.001 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' A' ' 71' ' ' SER . 2.0 tp-100 -95.03 -54.35 3.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.873 -177.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.806 ' HG ' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -122.87 -6.4 8.49 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -173.148 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 65.79 49.74 57.46 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.546 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.4 mp -70.95 97.5 1.44 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.735 0.302 . . . . 0.0 111.516 -176.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.911 ' HA ' HG12 ' A' ' 82' ' ' VAL . 0.0 OUTLIER -86.86 18.51 3.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.932 0.396 . . . . 0.0 111.323 179.743 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.4 -26.36 35.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.895 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 1.036 HD11 ' HB3' ' A' ' 68' ' ' ALA . 0.1 OUTLIER -126.03 -4.34 6.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.647 -178.309 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.911 HG12 ' HA ' ' A' ' 79' ' ' LEU . 1.9 p -104.68 141.33 20.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.21 0.529 . . . . 0.0 110.704 -177.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -129.37 174.92 9.18 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.465 177.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -133.67 107.76 8.14 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.951 0.405 . . . . 0.0 111.049 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.498 ' C ' ' H ' ' A' ' 87' ' ' GLU . 17.5 p -79.97 -168.82 1.76 Allowed 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 173.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -75.9 28.02 0.11 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.165 0.507 . . . . 0.0 110.403 173.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.498 ' H ' ' C ' ' A' ' 85' ' ' THR . 1.4 mm-40 -126.39 -101.32 0.37 Allowed 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.501 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -135.58 -158.83 8.36 Favored Glycine 0 N--CA 1.445 -0.71 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 178.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -69.01 117.84 5.29 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.552 2.168 . . . . 0.0 111.12 176.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.512 HG12 ' HB2' ' A' ' 18' ' ' PHE . 2.5 m -129.14 170.89 17.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.174 0.511 . . . . 0.0 111.74 -173.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.504 ' HB2' ' HE2' ' A' ' 116' ' ' LYS . 2.4 t -67.82 118.86 11.62 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.167 177.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 35.7 tttp -69.27 -30.15 68.2 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.114 -178.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.417 ' HB3' ' H ' ' A' ' 94' ' ' ILE . 0.6 OUTLIER -152.29 -105.84 0.05 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.142 0.496 . . . . 0.0 111.989 -173.407 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.443 HG23 ' HB3' ' A' ' 109' ' ' ASP . 3.7 mt -76.61 126.6 37.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.781 -168.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -91.7 132.22 36.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 175.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.497 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . . . -152.87 158.91 42.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.969 -176.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -105.85 116.71 32.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.966 0.412 . . . . 0.0 110.01 179.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.756 ' O ' ' HA ' ' A' ' 31' ' ' SER . 5.6 t -129.5 117.31 18.64 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.083 -173.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -73.71 146.1 37.9 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 122.648 2.232 . . . . 0.0 112.748 -178.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.3 129.11 35.9 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 173.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 130.09 -60.89 0.67 Allowed Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.792 -0.718 . . . . 0.0 111.91 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -169.36 174.79 5.85 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 122.917 0.487 . . . . 0.0 109.949 176.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 17.2 m 79.42 144.86 0.08 Allowed 'General case' 0 N--CA 1.462 0.159 0 O-C-N 124.043 0.84 . . . . 0.0 111.942 176.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.564 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -70.67 176.02 4.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.491 -1.231 . . . . 0.0 111.185 -178.049 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.471 ' HB3' ' CA ' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -110.96 141.96 43.7 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.898 -176.151 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 3.3 m -88.07 145.75 7.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.289 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.92 121.45 45.27 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.891 0.377 . . . . 0.0 111.084 -177.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.28 30.52 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.564 177.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.443 ' HB3' HG23 ' A' ' 94' ' ' ILE . 34.3 p-10 -76.04 -11.48 59.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.409 -175.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.54 -53.34 53.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.174 0.512 . . . . 0.0 111.314 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -97.94 47.12 1.01 Allowed 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.799 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -148.38 64.29 0.41 Allowed Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.769 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -78.9 65.76 4.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.049 0.452 . . . . 0.0 111.036 -176.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 147.4 85.84 0.06 OUTLIER Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.982 -0.628 . . . . 0.0 111.684 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 12.2 t -75.75 118.31 18.43 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.261 0.553 . . . . 0.0 111.16 -176.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.713 ' HD2' ' HA ' ' A' ' 18' ' ' PHE . 0.8 OUTLIER 58.55 42.36 20.94 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.034 176.353 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -118.76 144.68 46.12 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.394 -176.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 . . . . . 0 C--O 1.247 0.942 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 176.416 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 11.2 m . . . . . 0 N--CA 1.476 0.874 0 CA-C-O 120.692 0.282 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.478 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.1 OUTLIER -73.44 140.31 79.02 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.676 178.884 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 2' ' ' LEU . 8.3 Cg_exo -75.04 -179.37 4.93 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 123.137 2.558 . . . . 0.0 112.297 178.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 66.67 -70.17 0.11 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.529 0.732 . . . . 0.0 112.019 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.37 144.39 46.47 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.458 -179.012 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.2 65.68 3.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.357 0.599 . . . . 0.0 110.607 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.1 -0.57 22.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.872 -176.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.9 mmtt -84.77 -1.17 55.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.239 0.543 . . . . 0.0 110.383 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -91.86 -22.07 20.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.324 178.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.2 95.38 0.99 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.172 -177.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.484 ' HD2' ' HG2' ' A' ' 89' ' ' PRO . 0.5 OUTLIER -112.78 -93.36 0.47 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.065 179.119 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 65.0 6.87 3.66 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.696 0.622 . . . . 0.0 110.834 -176.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.14 -32.88 5.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.31 0.576 . . . . 0.0 110.221 178.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.29 -22.02 45.21 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.895 178.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.11 76.23 6.86 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.599 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.8 -28.36 65.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.315 0.579 . . . . 0.0 110.076 175.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.921 ' HB1' ' HB2' ' A' ' 116' ' ' LYS . . . -64.64 -33.44 75.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.397 177.032 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -72.67 -30.88 64.64 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.51 -38.28 86.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.939 174.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' A' ' 17' ' ' ALA . 1.4 mtpp -69.97 -36.88 75.55 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.688 0.756 . . . . 0.0 109.072 175.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.91 -25.24 68.06 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.787 176.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.459 ' HA ' HD11 ' A' ' 32' ' ' ILE . . . -68.61 -14.96 63.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.45 . . . . 0.0 112.019 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -110.6 9.4 23.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.096 0.474 . . . . 0.0 110.383 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.28 -12.5 73.15 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 175.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.3 m -151.83 139.97 20.24 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 176.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.73 97.29 1.06 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.639 0.257 . . . . 0.0 110.97 -179.109 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.8 m -149.21 165.59 31.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.123 -177.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.533 ' O ' ' HB ' ' A' ' 32' ' ' ILE . 21.2 m120 -115.83 174.7 5.89 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 t -55.6 -42.99 71.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -178.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.24 9.43 72.22 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.423 -0.894 . . . . 0.0 113.131 -176.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.498 ' OG ' ' HB2' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -131.57 2.71 4.15 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.139 0.495 . . . . 0.0 110.958 -179.82 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.533 ' HB ' ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -89.8 132.7 33.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.577 -179.484 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.705 ' HB2' ' HD2' ' A' ' 69' ' ' LYS . . . -145.07 156.16 43.75 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.485 0.659 . . . . 0.0 111.791 -175.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.3 t -108.64 130.85 55.32 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 115.107 -0.951 . . . . 0.0 108.514 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.643 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 60.1 m -116.68 154.43 30.6 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -178.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.63 ' OD1' ' HB ' ' A' ' 41' ' ' THR . 12.7 p30 -152.3 159.19 43.53 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.519 177.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.433 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.9 OUTLIER -54.88 133.42 66.7 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.733 176.633 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.709 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 54.8 Cg_exo -49.86 -31.42 26.53 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.557 2.838 . . . . 0.0 113.607 -172.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.25 -19.93 49.92 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -177.012 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.96 -53.18 3.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.772 -177.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.63 ' HB ' ' OD1' ' A' ' 36' ' ' ASN . 0.4 OUTLIER -69.4 -25.07 63.96 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.541 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.709 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.4 m-80 -91.98 15.78 12.5 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.041 -177.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -49.4 -33.73 14.56 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.894 -179.175 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.782 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 6.2 t70 -119.3 152.35 36.87 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.0 -24.32 40.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.396 -175.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 tp -85.36 -36.28 20.85 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 175.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.782 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.3 OUTLIER -52.3 -39.88 61.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.542 175.983 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.06 -18.25 65.14 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.145 -177.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -97.32 -25.88 10.63 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.065 -0.588 . . . . 0.0 111.837 176.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 94.2 mt -75.68 -9.04 58.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.771 0.319 . . . . 0.0 110.778 179.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.461 HD21 HG23 ' A' ' 41' ' ' THR . 0.1 OUTLIER -65.81 -13.53 59.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.007 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.433 ' HA3' ' HB2' ' A' ' 56' ' ' LEU . . . -148.91 94.05 0.15 Allowed Glycine 0 N--CA 1.444 -0.815 0 N-CA-C 111.228 -0.749 . . . . 0.0 111.228 176.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.466 ' HB3' HD11 ' A' ' 72' ' ' LEU . . . -81.42 63.46 5.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.02 0.438 . . . . 0.0 111.459 -171.648 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 154.49 52.94 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.546 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 60.75 43.69 11.95 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.919 0.39 . . . . 0.0 111.619 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.727 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 0.1 OUTLIER -85.95 -174.36 5.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.935 0.398 . . . . 0.0 111.084 179.712 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.525 ' H ' HD23 ' A' ' 56' ' ' LEU . 10.5 t-20 -132.88 -178.28 4.88 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.201 -178.478 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.545 ' HA2' ' HA ' ' A' ' 66' ' ' ALA . . . -107.42 -146.3 12.73 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.717 -0.674 . . . . 0.0 112.156 -177.282 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 12.9 tp -65.69 145.96 55.38 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.0 t -53.93 109.77 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.842 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.29 -51.08 4.44 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.81 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 24.6 t30 -81.32 94.35 6.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.307 0.575 . . . . 0.0 111.172 -176.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.73 129.08 38.68 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.324 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 131.95 -51.17 0.86 Allowed Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.793 178.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.89 68.82 7.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.878 0.371 . . . . 0.0 110.95 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.545 ' HA ' ' HA2' ' A' ' 58' ' ' GLY . . . -79.95 137.77 36.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.745 176.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.3 m -110.83 141.51 44.09 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.109 0.48 . . . . 0.0 111.774 -174.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.905 ' HB3' HD22 ' A' ' 81' ' ' LEU . . . -104.76 156.16 18.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.905 178.165 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.705 ' HD2' ' HB2' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -111.7 -178.42 3.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.201 -172.939 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.61 -37.96 83.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.695 0.283 . . . . 0.0 111.342 -177.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -41.39 94.9 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.473 0.654 . . . . 0.0 110.103 177.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.545 ' HA ' ' NE2' ' A' ' 75' ' ' GLN . 1.1 mp -72.57 -17.08 61.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.162 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -66.03 -34.09 67.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 173.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -101.01 -39.33 7.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.55 -174.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.545 ' NE2' ' HA ' ' A' ' 72' ' ' LEU . 0.0 OUTLIER -51.8 -29.68 20.08 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -174.8 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.482 HD13 ' HA ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -147.14 -17.82 0.4 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 111.871 0.322 . . . . 0.0 111.871 -178.479 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.41 51.96 5.01 Favored Glycine 0 CA--C 1.519 0.304 0 C-N-CA 119.935 -1.126 . . . . 0.0 112.406 178.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.02 84.62 0.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.107 0.479 . . . . 0.0 111.018 -178.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.451 ' HG ' ' H ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -69.55 -6.24 29.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.565 -174.693 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -77.72 -16.49 58.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.825 0.345 . . . . 0.0 110.735 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.905 HD22 ' HB3' ' A' ' 68' ' ' ALA . 0.4 OUTLIER -105.54 -25.09 12.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.517 -175.907 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.44 138.85 24.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.0 0.428 . . . . 0.0 111.007 -177.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.454 ' HB2' ' HG3' ' A' ' 92' ' ' LYS . 5.8 t70 -117.85 159.26 23.37 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 174.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.508 ' CE1' ' HA2' ' A' ' 88' ' ' GLY . 23.8 t-80 -111.58 110.91 21.56 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.204 0.526 . . . . 0.0 110.858 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.3 p -97.07 -167.81 1.6 Allowed 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.093 177.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.435 ' HG3' ' H ' ' A' ' 86' ' ' GLU . 16.6 mt-10 -51.12 -44.06 61.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.531 177.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.413 ' CD ' ' HB2' ' A' ' 17' ' ' ALA . 48.9 mp0 -72.83 -75.42 0.14 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.842 0.353 . . . . 0.0 111.148 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.508 ' HA2' ' CE1' ' A' ' 84' ' ' HIS . . . -168.65 -151.48 7.18 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.617 -176.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.484 ' HG2' ' HD2' ' A' ' 11' ' ' LYS . 13.4 Cg_exo -69.82 107.9 1.97 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 123.128 2.552 . . . . 0.0 111.703 178.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.468 HG11 ' HB3' ' A' ' 17' ' ' ALA . 1.0 OUTLIER -125.61 -173.3 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.014 -176.726 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 50.1 t -67.72 134.13 50.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.41 177.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.454 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 4.8 tttt -73.65 -36.04 65.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.792 -178.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.522 ' HB3' HG13 ' A' ' 94' ' ' ILE . 4.8 m-80 -146.66 -95.22 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -171.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.522 HG13 ' HB3' ' A' ' 93' ' ' ASN . 3.5 mt -93.57 132.86 36.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.888 -168.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.49 130.82 36.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.501 177.03 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.643 ' HB3' ' SG ' ' A' ' 35' ' ' CYS . . . -154.52 175.8 13.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.051 0.453 . . . . 0.0 111.476 -178.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.97 125.69 54.68 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.555 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.621 ' HB3' ' HD2' ' A' ' 69' ' ' LYS . 15.3 t -144.22 129.01 9.38 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.18 -176.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.469 ' O ' HD21 ' A' ' 56' ' ' LEU . 67.5 Cg_endo -87.86 129.83 2.56 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 122.95 2.433 . . . . 0.0 112.818 -176.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.687 ' HG2' ' HE2' ' A' ' 69' ' ' LYS . 4.7 mm-40 -77.31 97.28 4.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.109 0.48 . . . . 0.0 110.691 176.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.463 ' O ' ' HB ' ' A' ' 102' ' ' THR . . . 169.67 -53.01 0.2 Allowed Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 177.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.727 ' HA ' ' HA ' ' A' ' 56' ' ' LEU . 5.8 t 177.07 -176.33 0.14 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 71.95 158.96 0.2 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.343 0.592 . . . . 0.0 111.099 -176.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.497 ' HA ' ' HB3' ' A' ' 57' ' ' ASN . 1.0 OUTLIER -76.17 173.88 10.79 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.498 -175.755 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.5 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.3 OUTLIER -111.25 150.65 29.3 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.931 -179.467 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.467 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 6.0 m -106.6 133.48 51.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.891 0.377 . . . . 0.0 110.64 -177.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.98 119.55 39.67 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.316 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -114.28 13.44 8.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.062 0.458 . . . . 0.0 110.765 -178.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.17 122.3 19.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.312 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -130.68 81.43 2.0 Allowed 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.228 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 66.3 40.16 3.83 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.338 -177.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -116.31 -28.41 2.6 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.933 176.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.17 151.35 47.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.052 0.453 . . . . 0.0 111.363 178.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 119.54 -14.2 10.8 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.315 -179.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.4 t -137.82 170.06 16.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.904 0.383 . . . . 0.0 110.572 178.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.921 ' HB2' ' HB1' ' A' ' 17' ' ' ALA . 0.0 OUTLIER -128.79 -32.73 2.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.289 0.566 . . . . 0.0 110.182 179.817 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -120.69 139.85 52.46 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.751 -0.658 . . . . 0.0 109.894 177.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.443 -0.789 . . . . 0.0 109.977 178.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 CA-C-O 120.416 0.15 . . . . 0.0 110.857 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 mm? 53.31 74.13 0.82 Allowed Pre-proline 0 CA--C 1.531 0.248 0 O-C-N 123.906 0.754 . . . . 0.0 112.381 176.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -82.79 24.45 0.74 Allowed 'Trans proline' 0 CA--C 1.528 0.217 0 C-N-CA 122.967 2.445 . . . . 0.0 112.546 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.72 -33.0 74.86 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.329 -175.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.91 -7.6 59.53 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.313 179.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.51 3.08 45.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.041 0.448 . . . . 0.0 110.801 -179.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.59 143.8 54.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.903 179.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -149.6 127.08 11.54 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.293 0.568 . . . . 0.0 110.49 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.421 ' HB3' ' H ' ' A' ' 10' ' ' ALA . 21.5 m120 -113.72 -151.01 0.47 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.104 -178.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.421 ' H ' ' HB3' ' A' ' 9' ' ' ASN . . . -86.54 68.79 10.28 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.038 -178.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.09 150.86 27.96 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.186 176.147 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.468 ' HA ' HD22 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -78.75 -27.78 44.79 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.314 174.312 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.68 -28.72 69.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.629 -179.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.06 -27.06 61.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.184 0.516 . . . . 0.0 111.074 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -88.22 68.17 8.94 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.448 -176.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.51 -31.47 69.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.6 -29.45 70.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.934 174.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.584 ' HB2' HG12 ' A' ' 90' ' ' VAL . 69.9 t80 -84.47 -29.62 25.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.974 0.416 . . . . 0.0 110.466 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.43 -4.46 22.65 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.975 -178.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.47 -24.78 31.64 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 176.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.542 ' HG2' HG21 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -73.32 -27.34 61.47 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.858 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.12 -11.27 60.77 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.846 178.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -101.8 -47.54 4.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.103 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -72.08 -44.87 43.66 Favored Glycine 0 C--N 1.33 0.199 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.8 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.36 136.4 32.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.742 0.306 . . . . 0.0 110.918 -178.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.74 96.0 7.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.882 0.372 . . . . 0.0 111.618 -177.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.428 ' HB3' ' HB3' ' A' ' 97' ' ' CYS . 98.9 m -144.47 -178.85 6.19 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 176.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 31.8 t30 -102.66 134.78 45.46 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.4 p -62.57 -29.27 46.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 O-C-N 123.214 0.321 . . . . 0.0 111.334 -177.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -88.84 8.35 79.77 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.734 -0.746 . . . . 0.0 111.754 177.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.3 m -149.63 42.94 0.91 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.084 0.468 . . . . 0.0 110.408 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -97.65 140.14 18.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 176.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.479 ' CB ' ' HB3' ' A' ' 98' ' ' CYS . . . -148.67 160.88 42.73 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 121.194 0.521 . . . . 0.0 111.717 -173.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 21.5 m -114.6 131.98 56.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.158 173.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.429 ' SG ' ' HB3' ' A' ' 96' ' ' ALA . 2.8 m -122.23 164.94 16.98 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.297 -178.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.573 ' HB2' HD12 ' A' ' 81' ' ' LEU . 1.1 t30 -147.42 159.91 43.17 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.258 -179.571 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.05 142.1 37.1 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.786 175.103 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.508 ' O ' ' HB2' ' A' ' 42' ' ' ASN . 83.9 Cg_exo -47.6 -44.84 24.99 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.858 3.038 . . . . 0.0 114.73 -173.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.47 -15.32 62.53 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -173.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.569 ' CD ' ' HZ1' ' A' ' 92' ' ' LYS . 4.7 mt-10 -98.59 -48.52 4.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.539 0.685 . . . . 0.0 109.631 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.416 HG22 HD22 ' A' ' 51' ' ' LEU . 3.6 m -61.13 -34.6 75.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.11 177.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.508 ' HB2' ' O ' ' A' ' 38' ' ' PRO . 1.1 m-80 -104.93 15.2 28.17 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.779 -177.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -53.83 -40.16 66.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.481 -177.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 1.095 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 16.1 t70 -102.66 146.93 27.46 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.74 -179.343 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -34.19 77.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.86 -177.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 46' ' ' LEU . 6.3 tp -92.28 -24.29 19.02 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.089 0.471 . . . . 0.0 110.736 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 1.095 ' HB2' ' HB3' ' A' ' 44' ' ' ASP . 0.2 OUTLIER -58.85 -31.76 68.82 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.515 -177.613 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.44 ' HA ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -63.01 -11.76 21.28 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -176.537 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -117.42 -21.49 4.37 Favored Glycine 0 C--N 1.331 0.301 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 172.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.2 mp -84.3 -7.21 59.4 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.708 ' HA ' ' HG ' ' A' ' 78' ' ' LEU . 0.3 OUTLIER -70.55 -9.0 55.7 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.301 0.572 . . . . 0.0 109.975 179.08 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.637 ' HA2' HD23 ' A' ' 72' ' ' LEU . . . -128.44 -125.99 2.82 Favored Glycine 0 N--CA 1.438 -1.224 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 176.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -168.76 -24.6 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.358 0.599 . . . . 0.0 109.669 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -126.1 -157.98 9.76 Favored Glycine 0 N--CA 1.443 -0.878 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 172.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.459 ' O ' HG22 ' A' ' 102' ' ' THR . 0.2 OUTLIER -75.53 64.79 1.67 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.182 0.515 . . . . 0.0 110.927 179.761 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.701 ' HA ' ' O ' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -65.55 150.62 48.1 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.778 178.294 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -109.22 177.89 4.62 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 171.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -110.18 -154.18 14.38 Favored Glycine 0 CA--C 1.504 -0.603 0 C-N-CA 120.361 -0.923 . . . . 0.0 111.993 -173.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.683 ' HB3' ' HB2' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -65.46 139.54 58.52 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 178.37 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.2 m -56.77 96.48 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.5 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.11 19.12 56.46 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.883 178.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.683 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 1.1 t-20 -127.92 95.03 4.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.182 0.515 . . . . 0.0 109.92 178.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.33 88.4 3.14 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.612 -176.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 153.96 -43.74 0.6 Allowed Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.968 -0.634 . . . . 0.0 111.798 176.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.6 98.94 7.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.947 0.404 . . . . 0.0 110.675 179.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.51 171.58 9.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.982 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 79.4 m -134.68 140.08 45.73 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.273 -175.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -104.81 124.73 49.94 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.51 ' HG2' ' H ' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -85.19 157.17 20.71 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.259 -175.465 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.84 -36.31 72.11 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 m -63.55 -31.91 73.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.191 0.52 . . . . 0.0 110.44 176.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.714 ' HA ' ' HB2' ' A' ' 75' ' ' GLN . 0.3 OUTLIER -85.88 -18.82 31.72 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.897 -177.57 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.77 -37.98 81.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 172.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -79.8 -6.84 58.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.667 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.799 ' HB3' HD12 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -95.1 -42.3 8.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.245 -178.137 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.799 HD12 ' HB3' ' A' ' 75' ' ' GLN . 4.2 mp -134.79 -65.52 0.63 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.767 -177.437 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.58 50.27 1.86 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.35 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.708 ' HG ' ' HA ' ' A' ' 51' ' ' LEU . 1.8 mm? -59.66 107.03 0.54 Allowed 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 122.613 0.365 . . . . 0.0 110.797 -178.571 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.435 ' HG ' ' H ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.58 17.1 0.16 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.428 -171.941 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -93.13 -29.23 15.87 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.225 0.536 . . . . 0.0 109.659 173.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.573 HD12 ' HB2' ' A' ' 36' ' ' ASN . 0.5 OUTLIER -105.11 -1.7 25.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.664 -173.016 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.489 ' C ' ' HG2' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -123.6 137.61 56.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.292 0.568 . . . . 0.0 111.295 -178.955 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -90.19 174.06 7.82 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 173.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.7 72.28 1.4 Allowed 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 122.039 0.923 . . . . 0.0 110.508 -176.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.514 HG21 ' HE3' ' A' ' 116' ' ' LYS . 98.0 m -72.76 158.57 35.32 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 114.099 -1.409 . . . . 0.0 109.665 175.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -53.43 -35.59 60.62 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -177.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.03 -63.82 1.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.468 0.652 . . . . 0.0 110.327 177.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -173.37 -174.56 40.49 Favored Glycine 0 N--CA 1.44 -1.072 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -69.96 132.34 22.81 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.032 1.821 . . . . 0.0 110.846 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.584 HG12 ' HB2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -133.57 -178.53 2.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.934 -169.411 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.43 133.7 50.04 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.256 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.569 ' HZ1' ' CD ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -71.67 -46.84 57.66 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 -177.074 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -150.68 -70.54 0.18 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.837 -171.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.416 ' HB ' ' HB2' ' A' ' 35' ' ' CYS . 15.7 mt -98.88 120.91 48.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.183 -174.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.542 HG21 ' HG2' ' A' ' 21' ' ' GLN . 7.6 p -93.51 129.96 43.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.125 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.429 ' HB3' ' SG ' ' A' ' 35' ' ' CYS . . . -148.81 169.72 19.84 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.398 0.618 . . . . 0.0 111.561 -174.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.428 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -105.16 115.97 31.17 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.217 175.561 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.491 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 38.9 t -136.38 126.3 16.08 Favored Pre-proline 0 C--N 1.319 -0.723 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.87 -173.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -67.21 134.38 33.61 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.721 2.281 . . . . 0.0 111.462 178.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.451 ' HA ' ' HG3' ' A' ' 69' ' ' LYS . 1.3 tt0 -67.03 118.23 10.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.106 0.479 . . . . 0.0 109.894 176.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.701 ' O ' ' HA ' ' A' ' 56' ' ' LEU . . . 113.9 -115.93 3.73 Favored Glycine 0 N--CA 1.437 -1.296 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -176.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.459 HG22 ' O ' ' A' ' 55' ' ' LEU . 66.8 p -98.83 -174.84 2.89 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 123.659 0.27 . . . . 0.0 110.802 -173.071 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.1 m 74.07 151.67 0.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.686 0.755 . . . . 0.0 112.058 177.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -76.34 159.77 30.22 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.027 -175.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.491 ' HB3' ' HB2' ' A' ' 98' ' ' CYS . 0.0 OUTLIER -112.4 141.41 46.17 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.893 -179.75 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.42 ' O ' ' HB1' ' A' ' 96' ' ' ALA . 1.7 m -99.37 135.2 35.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.164 0.507 . . . . 0.0 111.185 -178.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -100.52 112.01 24.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.537 176.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 1.8 m -94.45 21.71 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -170.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -118.9 133.85 55.56 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.34 0.59 . . . . 0.0 111.108 177.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -151.7 25.6 0.66 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.888 -1.051 . . . . 0.0 108.582 173.034 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -133.45 -36.27 0.98 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.611 -175.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 77.53 80.0 0.69 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.778 -0.725 . . . . 0.0 111.866 -177.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -86.79 -43.53 12.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.151 0.501 . . . . 0.0 111.673 -177.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -164.8 -171.22 30.78 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.691 -178.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -107.43 -60.0 1.75 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.975 0.417 . . . . 0.0 111.123 -178.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.514 ' HE3' HG21 ' A' ' 85' ' ' THR . 0.0 OUTLIER -154.72 -79.35 0.09 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 175.474 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -95.2 77.9 3.48 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 171.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 . . . . . 0 C--O 1.256 1.435 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.668 -173.247 . . . . . . . . 0 0 . 1 stop_ save_