data_2jq8_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 2jq8 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.517 0 CA-C-O 120.909 0.385 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.48 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 1.2 m -91.99 128.3 37.78 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-O 120.959 0.409 . . . . 0.0 111.356 -178.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.93 -99.02 0.34 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.884 175.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.68 6.84 74.23 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.948 -177.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.545 ' HA ' ' OE1' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -85.94 45.54 1.23 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.147 0.498 . . . . 0.0 110.078 -176.423 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.3 t -133.76 17.06 3.91 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.603 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.73 -38.01 2.42 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.588 -176.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.545 ' OE1' ' HA ' ' A' ' 8' ' ' ARG . 2.4 pm0 -72.92 -26.58 61.45 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.818 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 126.59 175.07 14.01 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.654 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -68.5 116.04 8.6 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.9 0.381 . . . . 0.0 111.334 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.47 97.84 6.57 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 170.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -80.07 -2.86 5.77 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-O 121.304 0.573 . . . . 0.0 109.644 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -119.79 46.79 1.86 Allowed 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.384 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.58 172.11 12.29 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 171.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.13 -21.79 42.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.225 0.536 . . . . 0.0 110.171 178.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 t -149.18 138.48 21.54 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.027 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.565 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -130.68 151.98 50.53 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -168.151 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.5 m -142.46 120.13 11.83 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.573 172.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.521 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 28.7 t0 -154.31 -179.54 8.03 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 170.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.62 -22.54 65.33 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 167.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.6 mt -85.53 14.21 5.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.119 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.521 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -61.23 -39.3 89.8 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 178.707 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.29 -25.96 59.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.799 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -67.5 -47.83 68.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.731 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -90.04 -16.06 30.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.641 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.445 ' C ' ' HG ' ' A' ' 30' ' ' SER . 21.7 mt-30 58.86 50.53 8.43 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.423 0.63 . . . . 0.0 110.085 -173.034 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.445 ' HG ' ' C ' ' A' ' 29' ' ' GLN . 0.7 OUTLIER -147.92 78.22 1.44 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.506 -177.358 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.565 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.1 OUTLIER -127.73 147.42 50.4 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.325 175.162 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 5' ' ' CYS . 4.1 m -73.84 169.42 17.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.156 0.503 . . . . 0.0 111.741 178.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.65 -28.27 64.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.471 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.48 ' OD1' ' HB2' ' A' ' 5' ' ' CYS . 0.4 OUTLIER -89.56 17.05 6.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.763 0.316 . . . . 0.0 110.772 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -67.11 -48.03 69.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.564 0.697 . . . . 0.0 109.579 178.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -29.72 64.22 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.752 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.99 -57.79 4.59 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.388 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.429 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 24.5 mm-40 -78.96 -42.6 26.41 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -173.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.1 t -84.12 -55.4 4.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.363 -174.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 mttt 61.52 76.16 0.41 Allowed Pre-proline 0 N--CA 1.467 0.408 0 CA-C-O 121.103 0.478 . . . . 0.0 110.429 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo . . . . . 0 C--N 1.344 0.327 0 C-N-CA 122.67 2.246 . . . . 0.0 113.402 -174.58 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.388 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.625 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -86.27 121.69 29.2 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.804 -178.065 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -151.51 -88.32 0.06 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.461 -0.791 . . . . 0.0 108.999 176.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.46 34.43 2.9 Favored Glycine 0 N--CA 1.451 -0.366 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.136 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.49 ' HA ' ' HG2' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -128.13 10.54 6.38 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.831 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.615 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 4.0 t -115.0 -11.29 12.15 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 173.34 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.88 -6.06 20.53 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.191 -177.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.49 ' HG2' ' HA ' ' A' ' 8' ' ' ARG . 22.0 pt-20 -105.05 -14.56 15.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.988 -177.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.21 149.94 25.86 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.915 -176.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.435 ' CE2' ' HG2' ' A' ' 20' ' ' GLN . 2.6 t80 -56.94 109.12 0.59 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.11 0.481 . . . . 0.0 111.869 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.5 ' C ' ' H ' ' A' ' 16' ' ' ASP . 54.7 t30 -99.98 113.46 26.05 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 170.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.2 t -78.83 39.08 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.818 0.818 . . . . 0.0 110.509 -177.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.5 ' H ' ' C ' ' A' ' 14' ' ' ASN . 24.5 t0 -151.35 29.19 0.63 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.036 173.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.573 ' HB2' HE22 ' A' ' 20' ' ' GLN . 7.0 mmtp -110.09 155.06 22.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.468 175.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -74.09 0.11 Allowed 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.324 0.39 . . . . 0.0 111.032 178.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -102.4 154.97 18.57 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 174.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.573 HE22 ' HB2' ' A' ' 17' ' ' LYS . 1.1 tp-100 -138.62 146.71 42.05 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -171.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.615 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 39.8 m -140.56 117.69 11.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.21 -0.904 . . . . 0.0 108.866 168.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.533 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 10.7 t70 -154.76 179.4 9.12 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -69.38 -35.11 75.48 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 165.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 40.7 mt -74.93 2.29 10.73 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.393 178.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.533 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -63.72 -33.74 76.32 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 178.218 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -36.12 63.09 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.128 0.489 . . . . 0.0 110.488 176.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -62.76 -46.45 87.98 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.431 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -89.44 -8.74 52.37 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.338 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 52.91 47.22 25.15 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.201 0.524 . . . . 0.0 111.473 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.4 m -148.06 73.41 1.26 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.604 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -120.15 152.08 38.16 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.852 0.358 . . . . 0.0 110.883 177.216 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.489 ' SG ' ' SG ' ' A' ' 5' ' ' CYS . 1.6 m -76.34 159.06 30.88 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.101 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -25.87 67.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.012 0.434 . . . . 0.0 111.515 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.2 15.62 4.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.798 -177.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.437 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 23.3 t80 -65.79 -50.8 63.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.425 0.631 . . . . 0.0 110.162 -177.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.13 -29.5 62.94 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.048 -176.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.86 -49.91 59.47 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.212 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.625 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 31.1 mm-40 -84.35 -51.38 7.01 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.26 -0.427 . . . . 0.0 112.15 -174.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.09 -42.55 23.41 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.852 -175.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.18 56.32 14.1 Favored Pre-proline 0 N--CA 1.469 0.475 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 177.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo . . . . . 0 C--N 1.347 0.488 0 C-N-CA 122.22 1.946 . . . . 0.0 112.726 -178.31 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m . . . . . 0 N--CA 1.445 -0.68 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.588 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -71.09 149.52 46.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.635 -175.387 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -144.48 -104.42 0.11 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.138 173.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -89.72 37.5 3.34 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.961 -0.638 . . . . 0.0 113.438 -173.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.539 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -74.18 -26.39 60.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.003 0.43 . . . . 0.0 110.025 177.54 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.412 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 0.8 OUTLIER -72.71 -23.85 60.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.754 -174.676 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.64 -36.13 16.43 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.906 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -71.36 -43.33 67.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.274 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 119.65 175.03 15.76 Favored Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 111.364 -0.694 . . . . 0.0 111.364 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.41 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 4.2 t80 -76.02 107.63 8.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.166 0.508 . . . . 0.0 110.515 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -93.23 100.79 13.09 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.737 174.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.3 t -77.44 52.23 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.853 0.835 . . . . 0.0 110.457 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -151.67 -30.66 0.16 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.188 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.532 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -77.02 163.43 26.69 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.17 176.278 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -77.61 -62.9 1.51 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.245 -171.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.74 138.61 34.04 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.569 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -130.86 142.91 50.41 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.703 -173.086 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 92.6 m -135.72 118.01 15.62 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 170.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.448 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 14.9 t70 -153.77 178.54 9.77 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 177.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.81 -25.87 63.98 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 166.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.432 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 0.3 OUTLIER -80.74 14.32 2.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.511 176.205 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.448 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -63.46 -47.52 81.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.551 -178.739 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.72 -25.61 66.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.224 0.535 . . . . 0.0 110.928 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.432 ' HB3' ' O ' ' A' ' 24' ' ' LEU . 78.0 t80 -63.29 -39.03 93.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.784 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -105.01 -16.44 14.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.414 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 58.1 38.78 26.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.284 0.564 . . . . 0.0 110.717 -177.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.4 m -127.57 41.47 3.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.761 -177.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.569 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.88 150.1 21.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.624 -179.538 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.0 m -73.24 154.11 40.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.333 177.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.87 -37.45 79.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.92 0.391 . . . . 0.0 111.773 -178.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.14 40.22 1.04 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.593 0.711 . . . . 0.0 110.889 -179.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.421 ' HD1' ' SG ' ' A' ' 21' ' ' CYS . 19.8 t80 -70.87 -42.78 69.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.688 178.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -31.8 72.97 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.354 -178.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.88 -43.56 79.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.804 -178.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 63.7 mm-40 -95.0 -37.59 11.06 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -173.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.9 t -82.38 -48.86 10.65 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.367 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 47.93 62.86 11.26 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.102 -177.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo . . . . . 0 C--N 1.345 0.377 0 C-N-CA 122.694 2.263 . . . . 0.0 113.299 -171.833 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 120.886 0.374 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.504 ' HA ' ' HG3' ' A' ' 8' ' ' ARG . 30.3 m -100.29 131.85 45.99 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.439 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.13 -68.63 0.87 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.13 0.49 . . . . 0.0 109.839 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -115.32 29.89 7.05 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 178.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.504 ' HG3' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -96.66 61.3 1.89 Allowed 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 -176.204 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -166.92 45.25 0.06 Allowed 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.34 -1.3 . . . . 0.0 109.323 171.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -163.86 -37.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.205 -175.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -77.63 -31.06 52.57 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.783 -176.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 115.41 162.02 13.32 Favored Glycine 0 N--CA 1.439 -1.131 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -170.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -59.25 114.37 2.6 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 117.145 0.472 . . . . 0.0 111.389 -175.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -77.88 85.86 4.12 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.734 174.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -71.73 -6.45 7.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 121.263 0.554 . . . . 0.0 109.627 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.13 -32.48 50.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.82 174.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.537 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -72.3 172.71 9.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.411 0.624 . . . . 0.0 112.094 -168.452 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.49 -51.28 5.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.307 -179.037 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.6 t -103.63 138.4 40.34 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 169.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.713 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.8 mm-40 -118.98 132.44 56.07 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.469 0.652 . . . . 0.0 112.652 -167.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.59 119.49 14.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.625 169.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.43 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 5.9 t70 -156.64 -168.78 2.79 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 165.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.19 -29.31 70.68 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.736 0.779 . . . . 0.0 108.952 169.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.07 14.66 10.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.667 -178.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.43 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -62.22 -37.99 87.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.623 0.249 . . . . 0.0 110.862 -178.61 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.85 -26.7 63.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.934 0.397 . . . . 0.0 111.011 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -67.42 -36.32 81.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.943 -178.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -100.72 -15.69 17.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.91 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 53.53 58.54 5.08 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.075 -178.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.7 m -148.77 48.42 1.01 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.472 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.713 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.63 138.08 34.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.908 0.385 . . . . 0.0 111.397 -176.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.13 162.23 28.69 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.837 177.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -27.22 68.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.257 0.551 . . . . 0.0 111.018 177.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.87 -10.29 59.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.37 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.437 ' CE2' ' HG3' ' A' ' 41' ' ' PRO . 31.7 t80 -67.33 -46.66 72.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.361 0.601 . . . . 0.0 110.048 -176.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.61 -29.35 62.32 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.64 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.87 -50.42 42.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.429 178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.422 ' OE1' ' HA ' ' A' ' 38' ' ' GLU . 4.9 mm-40 -88.71 -43.26 11.43 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -173.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.0 t -84.33 -42.96 15.24 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.592 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.93 65.36 3.35 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.251 178.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.437 ' HG3' ' CE2' ' A' ' 35' ' ' TYR . 87.8 Cg_endo . . . . . 0 C--N 1.345 0.37 0 C-N-CA 122.375 2.05 . . . . 0.0 111.017 175.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.446 -0.641 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -85.44 138.33 32.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.794 -176.65 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -125.9 -52.1 1.56 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 173.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -166.22 43.26 0.27 Allowed Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.662 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.41 ' HD2' ' SG ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -95.44 12.42 29.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.412 0.625 . . . . 0.0 109.99 177.925 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -79.89 -2.59 44.3 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.433 179.624 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.94 -1.78 18.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.346 -178.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -98.49 -8.78 26.07 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.719 0.295 . . . . 0.0 110.743 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.68 162.32 35.96 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.138 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.577 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 4.5 t80 -74.77 106.87 6.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.278 0.561 . . . . 0.0 110.438 177.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.448 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -99.85 102.27 13.64 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.099 174.523 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -78.54 41.13 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.12 0.486 . . . . 0.0 110.758 -175.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.407 ' H ' ' C ' ' A' ' 14' ' ' ASN . 6.8 t0 -166.69 24.32 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.033 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.448 ' HG2' ' HB3' ' A' ' 14' ' ' ASN . 9.0 mmtm -89.3 -103.44 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.175 0.512 . . . . 0.0 110.228 176.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.429 ' HG3' ' C ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -150.48 -56.06 0.16 Allowed 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.161 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -124.84 147.76 48.58 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.465 171.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.626 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 2.7 mp0 -125.32 131.66 53.0 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.898 0.38 . . . . 0.0 111.679 -171.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.457 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 11.4 m -137.88 118.98 14.42 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 170.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -152.1 -170.62 3.69 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -69.05 -30.92 69.36 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 167.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mt -85.66 14.99 5.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.843 -178.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.577 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -63.55 -39.49 94.54 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 178.401 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.99 -28.52 62.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.833 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -65.49 -47.37 76.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.708 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -89.33 -11.97 41.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.008 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 53.81 43.78 30.49 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.175 0.512 . . . . 0.0 110.516 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 m -139.55 58.59 1.61 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.874 -176.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.626 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -110.48 156.0 21.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.329 177.096 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.6 m -72.48 156.2 39.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.491 177.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -22.34 66.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.988 -177.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.46 21.48 12.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.107 -177.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.487 ' O ' ' HB2' ' A' ' 39' ' ' CYS . 20.8 t80 -60.82 -50.96 71.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.119 0.485 . . . . 0.0 110.683 -177.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.457 ' O ' ' HE2' ' A' ' 40' ' ' LYS . 0.8 OUTLIER -72.98 -30.27 63.68 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.381 -177.383 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.72 -46.33 66.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.655 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 71.6 mm-40 -95.86 -39.99 9.54 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -173.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 96.0 m -82.43 -44.45 16.05 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.808 -178.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.457 ' HE2' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 59.32 78.0 0.36 Allowed Pre-proline 0 CA--C 1.531 0.221 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.147 179.851 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo . . . . . 0 CA--C 1.531 0.354 0 C-N-CA 122.829 2.353 . . . . 0.0 112.589 -179.632 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.452 -0.36 0 CA-C-O 121.114 0.483 . . . . 0.0 111.315 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.541 ' H ' ' HB2' ' A' ' 34' ' ' ASP . 3.1 t -85.48 143.24 28.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.537 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.34 -89.83 0.51 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.851 0.358 . . . . 0.0 110.064 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.98 47.12 1.04 Allowed Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.711 -0.757 . . . . 0.0 111.646 178.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.475 ' HB2' ' NH1' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.27 8.23 36.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.112 0.482 . . . . 0.0 110.341 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.3 -15.04 48.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.35 0.595 . . . . 0.0 109.96 177.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.36 -10.12 59.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.177 -178.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -102.15 -5.89 23.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.546 178.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 79.15 -177.56 54.16 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.266 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -72.11 108.55 5.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.02 0.438 . . . . 0.0 110.798 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.46 ' C ' ' H ' ' A' ' 16' ' ' ASP . 2.0 t30 -99.14 105.57 17.66 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.583 172.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -78.8 41.28 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.667 0.746 . . . . 0.0 110.157 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.46 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -128.35 -20.87 3.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.056 -0.974 . . . . 0.0 110.128 178.391 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.454 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 29.8 mmtm -91.31 -175.02 4.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.218 0.532 . . . . 0.0 111.495 -173.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.471 ' H ' ' HD2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -87.5 -69.52 0.68 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.248 -177.624 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.27 139.19 35.29 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 174.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.57 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -126.32 148.84 49.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.815 0.34 . . . . 0.0 110.886 -175.813 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 69.1 m -133.8 116.59 15.88 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 171.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.402 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 14.4 t70 -154.12 178.0 10.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.182 176.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.96 -27.21 64.55 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 168.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 54.1 mt -82.46 14.7 2.88 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.406 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.405 ' HB2' ' HB3' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -58.63 -40.68 84.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.702 0.287 . . . . 0.0 110.743 -179.584 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -25.9 59.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.032 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -64.83 -49.4 70.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.584 -178.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -88.68 -15.92 33.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.844 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.69 48.85 5.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.308 -176.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 44.0 m -149.13 73.21 1.2 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.763 -178.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.57 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -114.42 149.01 36.86 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.021 177.004 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -75.63 152.76 37.57 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 175.934 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.85 -33.52 74.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -174.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.541 ' HB2' ' H ' ' A' ' 5' ' ' CYS . 0.8 OUTLIER -86.58 24.52 1.41 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.593 -176.568 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.489 ' O ' ' HB2' ' A' ' 39' ' ' CYS . 19.5 t80 -67.27 -50.72 59.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.231 0.539 . . . . 0.0 110.455 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.492 ' O ' ' HE3' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -73.65 -30.59 63.02 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.347 -175.783 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.69 -53.52 18.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.505 -178.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -90.76 -37.76 13.46 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -172.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.489 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 73.6 m -82.08 -55.93 4.26 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.179 -176.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.492 ' HE3' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 60.64 79.81 0.28 Allowed Pre-proline 0 N--CA 1.463 0.203 0 O-C-N 123.427 0.454 . . . . 0.0 110.904 179.609 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo . . . . . 0 CA--C 1.532 0.386 0 C-N-CA 123.119 2.546 . . . . 0.0 113.333 -176.566 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.655 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.56 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 1.6 t -87.91 142.82 27.5 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.834 0.35 . . . . 0.0 110.742 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.447 ' HA ' ' HG3' ' A' ' 38' ' ' GLU . 14.4 mmtt -134.58 -79.42 0.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.722 175.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -132.82 59.85 0.68 Allowed Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.025 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.555 ' NH2' ' HB3' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -128.44 28.76 5.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.054 0.454 . . . . 0.0 110.218 178.413 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.1 OUTLIER -110.46 -11.51 14.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.283 177.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.32 -12.48 40.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.506 -177.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -96.91 -18.37 19.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.724 -177.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 118.94 -176.55 16.12 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.473 -177.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.674 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 9.4 t80 -81.73 108.34 15.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.881 0.372 . . . . 0.0 110.62 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -79.14 94.16 5.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.013 174.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -86.11 36.03 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-O 121.286 0.565 . . . . 0.0 110.519 -177.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -138.06 -13.23 1.42 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.823 -176.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 1.0 OUTLIER -92.84 -172.27 2.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.229 0.538 . . . . 0.0 111.963 -170.554 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.21 -17.3 46.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.258 -179.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.555 ' HB3' ' NH2' ' A' ' 8' ' ' ARG . 5.6 t -162.81 142.12 8.94 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.091 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.573 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -127.44 150.97 49.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.78 0.324 . . . . 0.0 111.311 -171.281 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.502 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 86.9 m -142.1 117.73 10.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.271 173.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.445 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 17.5 t70 -153.81 -177.77 6.61 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 171.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -68.61 -28.97 67.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 167.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mt -77.39 12.12 1.68 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.508 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.674 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -57.34 -42.57 82.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.074 179.51 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.44 -27.16 60.48 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.916 0.389 . . . . 0.0 111.084 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -67.41 -44.26 79.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.404 -178.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -90.72 -16.06 29.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.932 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 56.9 54.34 7.21 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.138 -174.102 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.2 m -154.34 76.64 1.04 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.156 -178.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.573 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -125.16 148.48 48.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.505 176.789 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.56 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 5.4 m -70.89 154.37 41.88 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.555 175.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.99 -28.74 69.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.617 -178.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.74 21.56 4.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.045 -178.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -65.36 -47.33 76.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.762 0.792 . . . . 0.0 109.285 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.444 ' O ' ' HE2' ' A' ' 40' ' ' LYS . 0.5 OUTLIER -74.06 -29.71 62.03 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.014 -179.755 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.71 -40.6 76.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.853 -177.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.447 ' HG3' ' HA ' ' A' ' 6' ' ' LYS . 64.8 mm-40 -98.38 -51.01 4.11 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -175.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 4.3 m -73.52 -34.68 65.38 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -177.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.444 ' HE2' ' O ' ' A' ' 36' ' ' THR . 0.2 OUTLIER 52.04 75.54 0.64 Allowed Pre-proline 0 N--CA 1.465 0.287 0 O-C-N 123.66 0.6 . . . . 0.0 112.232 173.892 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo . . . . . 0 CA--C 1.529 0.264 0 C-N-CA 123.327 2.685 . . . . 0.0 111.748 176.562 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.7 m . . . . . 0 N--CA 1.446 -0.642 0 CA-C-O 121.1 0.476 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.622 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -78.55 127.64 32.43 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.094 178.539 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -98.71 -88.08 0.33 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.324 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.32 49.33 0.92 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 120.678 -0.772 . . . . 0.0 111.979 177.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.622 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 4.8 mmt85 -76.05 -6.83 52.9 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.826 0.346 . . . . 0.0 110.782 -175.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.421 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 23.7 m -79.53 -7.4 58.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.226 -176.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.54 -36.58 10.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.649 0.262 . . . . 0.0 111.062 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.39 -46.97 29.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.988 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 124.02 -178.69 16.37 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.013 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.659 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 4.0 t80 -79.53 108.5 13.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.879 0.371 . . . . 0.0 111.559 -178.134 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -94.44 105.09 17.05 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 168.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 t -64.41 -21.52 29.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.264 0.554 . . . . 0.0 109.916 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -94.54 41.04 1.09 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.074 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.416 ' HA ' ' HD2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -119.27 165.55 14.12 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 170.271 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.64 -19.51 27.62 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.336 0.589 . . . . 0.0 110.143 -176.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.7 t -146.55 139.47 25.41 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 175.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.607 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -130.15 142.39 50.59 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -171.053 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.464 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 66.1 m -138.18 117.32 12.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.546 167.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -154.9 179.97 8.61 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 175.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -15.53 63.42 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 166.26 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.8 mt -89.9 0.25 57.17 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.376 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.659 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -66.27 -25.58 66.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.735 0.303 . . . . 0.0 110.802 -176.337 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -39.82 62.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.896 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -63.35 -40.37 97.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.972 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -88.44 -15.44 35.44 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.321 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 54.64 45.28 27.15 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.53 -177.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.27 70.19 1.22 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.185 -178.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.607 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -109.61 148.61 31.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.118 176.154 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 21.1 m -65.29 157.77 28.16 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.931 0.396 . . . . 0.0 111.496 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.38 -26.18 63.6 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.277 0.56 . . . . 0.0 110.85 178.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.61 15.86 13.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.254 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.579 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 16.2 t80 -71.23 -39.46 71.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.699 -178.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -35.27 65.86 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.981 -179.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.07 -48.28 58.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.931 -178.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -90.81 -42.87 10.41 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -174.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.579 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 35.9 t -82.42 -51.94 7.36 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.379 -175.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.429 ' HE3' ' HB2' ' A' ' 40' ' ' LYS . 0.4 OUTLIER 57.72 75.56 0.54 Allowed Pre-proline 0 CA--C 1.531 0.242 0 O-C-N 123.607 0.567 . . . . 0.0 111.151 176.719 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo . . . . . 0 C--N 1.348 0.507 0 C-N-CA 123.089 2.526 . . . . 0.0 112.65 179.944 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 C--O 1.236 0.359 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 2.6 t -80.33 138.18 36.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.801 0.334 . . . . 0.0 110.262 -178.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -134.28 -81.79 0.45 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.104 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -112.09 31.93 6.66 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 176.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.655 ' O ' ' HB2' ' A' ' 21' ' ' CYS . 2.9 mtt-85 -86.51 54.07 3.03 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 121.586 0.708 . . . . 0.0 109.87 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 39' ' ' CYS . 0.0 OUTLIER -150.64 18.64 0.81 Allowed 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 167.28 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.69 -36.65 0.21 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.924 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.505 ' HG2' ' HA ' ' A' ' 8' ' ' ARG . 17.2 pt-20 -68.6 -25.07 64.68 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.079 178.107 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 102.7 161.23 25.87 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.246 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.538 ' CE1' ' HG3' ' A' ' 20' ' ' GLN . 3.9 t80 -68.4 119.27 12.63 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.269 0.557 . . . . 0.0 110.607 178.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.527 ' HB3' ' HB2' ' A' ' 17' ' ' LYS . 4.2 t-20 -103.34 104.15 14.23 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.895 175.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -79.47 51.47 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 176.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -157.52 -41.99 0.07 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.671 -1.15 . . . . 0.0 109.475 -174.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.527 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -67.18 126.48 29.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.009 174.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.42 -59.26 1.63 Allowed 'General case' 0 N--CA 1.474 0.767 0 O-C-N 124.014 0.821 . . . . 0.0 113.172 -175.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -100.12 143.84 29.86 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 177.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.637 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.4 mm-40 -131.34 145.17 51.73 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.127 0.489 . . . . 0.0 112.108 -173.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.806 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 1.8 m -136.4 120.22 17.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.441 171.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.419 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 10.4 t70 -154.87 -171.49 3.85 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 172.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.04 -33.03 72.95 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 107.248 -1.389 . . . . 0.0 107.248 162.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.9 mp -77.85 14.39 1.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.557 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -65.59 -37.36 86.4 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 176.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -26.31 62.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.167 0.508 . . . . 0.0 110.582 176.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.4 ' HD2' ' CD2' ' A' ' 28' ' ' TYR . 91.7 t80 -66.34 -39.77 89.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.093 -178.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.4 ' CD2' ' HD2' ' A' ' 27' ' ' TYR . 43.6 m-85 -102.87 -8.68 20.54 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.657 0.265 . . . . 0.0 110.709 177.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 50.68 48.7 22.27 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.771 -177.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.6 m -140.22 54.34 1.63 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.51 -177.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.637 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.95 137.09 36.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.43 -178.316 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.23 151.77 43.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.943 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.9 -27.61 66.87 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -174.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.06 13.4 18.95 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.194 -176.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.806 ' CD1' ' HB3' ' A' ' 21' ' ' CYS . 3.3 t80 -63.86 -48.45 76.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.2 -178.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.07 -31.21 68.69 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.298 -177.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.58 -51.53 27.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.359 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -77.58 -49.52 14.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.983 -174.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 9' ' ' CYS . 1.4 t -85.27 -54.49 4.57 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.85 -175.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 61.28 78.19 0.32 Allowed Pre-proline 0 C--O 1.233 0.225 0 O-C-N 123.49 0.494 . . . . 0.0 110.861 -177.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo . . . . . 0 C--N 1.347 0.455 0 C-N-CA 122.783 2.322 . . . . 0.0 112.313 179.783 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.315 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.507 ' HB2' ' HB2' ' A' ' 38' ' ' GLU . 87.0 m -65.74 153.45 41.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.432 0.634 . . . . 0.0 111.156 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.51 ' O ' ' HE3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -151.71 31.08 0.57 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.468 0.651 . . . . 0.0 109.397 175.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 80.58 33.4 31.14 Favored Glycine 0 N--CA 1.443 -0.84 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.806 -174.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -4.99 44.23 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.96 0.41 . . . . 0.0 110.288 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.583 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 35.3 m -68.7 1.74 3.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.162 177.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 p -86.26 -24.23 26.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.148 0.499 . . . . 0.0 110.319 176.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -98.76 -6.22 29.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.274 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.91 -166.76 34.13 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.316 -176.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.444 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 15.7 t80 -70.55 108.11 4.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.944 0.402 . . . . 0.0 110.822 178.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -78.23 86.29 4.35 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.416 176.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.8 56.54 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.811 0.815 . . . . 0.0 109.571 177.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -155.01 -41.35 0.09 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.761 -1.109 . . . . 0.0 109.242 -176.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.534 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -76.17 173.02 11.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.846 -179.392 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.431 ' HE3' ' HB2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -85.59 -36.78 20.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.661 -174.718 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -111.5 138.73 47.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.688 174.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.524 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 18.9 mp0 -123.83 138.17 54.54 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.919 0.39 . . . . 0.0 111.195 -175.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.583 ' HB2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -139.7 117.35 11.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.138 0.494 . . . . 0.0 109.751 167.822 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -154.23 -176.57 5.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.086 -0.961 . . . . 0.0 108.691 175.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.52 -33.22 73.74 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 166.632 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.0 mt -75.51 14.43 0.61 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.799 178.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.441 ' HB2' ' HB3' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -61.57 -38.13 86.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.785 0.326 . . . . 0.0 110.194 -179.539 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.77 -26.52 59.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.113 178.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -64.94 -40.83 95.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.726 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -98.32 -13.35 20.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.651 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 55.56 48.88 17.76 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.477 0.656 . . . . 0.0 110.076 -174.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 27.3 m -149.3 76.85 1.34 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.945 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.524 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -120.74 150.96 40.16 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.931 176.617 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 3.5 m -70.81 144.25 50.87 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -29.55 69.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.895 0.378 . . . . 0.0 111.296 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -91.0 31.29 1.1 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.194 0.521 . . . . 0.0 110.957 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -65.52 -40.58 93.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.647 0.737 . . . . 0.0 109.652 179.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.404 ' HA ' ' HD2' ' A' ' 41' ' ' PRO . 0.1 OUTLIER -72.05 -34.08 68.49 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.726 179.73 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -71.12 -55.06 8.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.198 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.507 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 32.7 mt-10 -97.51 0.43 47.51 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -169.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -126.6 -36.74 2.22 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.444 173.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.24 74.87 0.51 Allowed Pre-proline 0 N--CA 1.465 0.29 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 171.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 36' ' ' THR . 17.8 Cg_endo . . . . . 0 C--N 1.344 0.301 0 C-N-CA 122.275 1.984 . . . . 0.0 111.831 177.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.448 -0.555 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.484 ' H ' ' HB2' ' A' ' 34' ' ' ASP . 0.9 OUTLIER -84.39 154.13 23.02 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.629 -178.315 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.535 ' HG3' ' N ' ' A' ' 7' ' ' GLY . 0.0 OUTLIER -164.01 -33.77 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.91 177.388 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . 0.535 ' N ' ' HG3' ' A' ' 6' ' ' LYS . . . -154.47 63.35 0.35 Allowed Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.211 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.41 -37.34 1.63 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 175.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.4 -21.2 65.6 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.748 -178.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -85.69 -13.03 49.74 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.355 -176.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -111.16 -54.7 2.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.657 -177.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.99 -171.14 26.25 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.695 -0.765 . . . . 0.0 111.853 -179.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.702 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 3.2 t80 -83.61 112.48 20.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.921 0.391 . . . . 0.0 111.137 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.457 ' C ' ' H ' ' A' ' 16' ' ' ASP . 1.5 t30 -99.57 103.0 14.68 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 171.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -78.53 42.67 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.512 0.673 . . . . 0.0 109.962 -177.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.457 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -128.8 -27.66 2.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.405 -178.555 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.506 ' HB2' ' OE1' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -87.15 -165.58 1.34 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.786 -177.37 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.46 -61.88 1.47 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.186 -178.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -110.22 138.88 46.0 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.273 0.558 . . . . 0.0 109.86 176.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.638 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 4.2 mp0 -120.32 152.42 37.85 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.622 -177.05 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.483 ' HB3' ' CD2' ' A' ' 35' ' ' TYR . 86.2 m -123.12 113.44 18.98 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 168.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.487 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 13.1 t70 -156.66 179.04 9.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.995 178.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.46 -35.53 75.72 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 165.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.1 mt -77.11 9.38 3.07 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.654 -179.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.702 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -60.86 -41.74 96.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.169 -175.963 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.66 -29.89 63.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.247 -177.003 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -62.85 -48.92 76.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.782 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -84.0 -15.16 48.69 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.226 177.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.82 45.35 15.57 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.611 -178.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -138.17 63.03 1.55 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.465 -178.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.638 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -102.77 153.28 20.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.875 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.446 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 1.9 m -82.16 139.08 34.54 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 171.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -21.91 65.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.278 0.561 . . . . 0.0 111.474 -177.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.484 ' HB2' ' H ' ' A' ' 5' ' ' CYS . 0.7 OUTLIER -86.04 17.85 3.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.237 -175.345 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.483 ' CD2' ' HB3' ' A' ' 21' ' ' CYS . 15.0 t80 -64.53 -55.57 19.7 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.369 0.605 . . . . 0.0 110.409 -178.309 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.2 p -70.62 -29.03 65.3 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.254 -175.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -68.47 -55.08 13.01 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.892 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -91.36 -50.98 5.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.3 m -71.53 -47.27 56.27 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 121.225 -0.19 . . . . 0.0 111.055 -173.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 mtpp 59.36 77.5 0.39 Allowed Pre-proline 0 N--CA 1.464 0.231 0 O-C-N 123.409 0.443 . . . . 0.0 110.569 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo . . . . . 0 C--N 1.343 0.279 0 C-N-CA 123.313 2.675 . . . . 0.0 112.573 -175.362 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.536 ' HA ' ' HB2' ' A' ' 34' ' ' ASP . 0.8 OUTLIER . . . . . 0 N--CA 1.448 -0.527 0 CA-C-O 120.998 0.428 . . . . 0.0 110.857 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.452 ' HB3' ' HG3' ' A' ' 8' ' ' ARG . 2.8 m -77.97 119.7 21.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.904 177.356 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 mtmt -119.76 -54.77 2.13 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 176.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.88 -17.85 42.62 Favored Glycine 0 N--CA 1.44 -1.079 0 CA-C-N 115.276 -0.875 . . . . 0.0 112.349 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.452 ' HG3' ' HB3' ' A' ' 5' ' ' CYS . 0.1 OUTLIER -98.62 40.85 1.17 Allowed 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 122.025 -0.691 . . . . 0.0 110.501 -173.456 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.626 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.8 OUTLIER -131.44 -7.29 3.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.455 177.007 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.39 2.47 8.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.72 -174.573 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -104.68 12.21 33.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.225 0.536 . . . . 0.0 110.389 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 86.75 -173.29 45.2 Favored Glycine 0 N--CA 1.442 -0.953 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.61 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 7.9 t80 -93.73 107.13 19.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.691 0.282 . . . . 0.0 110.439 -178.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.421 ' C ' ' H ' ' A' ' 16' ' ' ASP . 0.8 OUTLIER -84.36 95.25 8.68 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.851 173.678 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -80.78 41.32 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.522 0.677 . . . . 0.0 110.115 -178.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.421 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -134.31 -13.26 2.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.051 -178.335 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.436 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 13.9 mmtm -91.85 179.3 5.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.143 0.497 . . . . 0.0 111.904 -170.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.92 -29.88 28.86 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.622 -178.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -140.01 149.45 43.23 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.61 ' HG2' ' CE1' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -130.73 146.09 52.11 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.999 -174.265 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.626 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 4.1 m -143.88 117.79 9.38 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 169.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.574 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 17.6 t70 -154.64 -179.35 7.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -69.12 -29.48 67.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 166.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 50.5 mt -79.56 14.42 1.65 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.167 176.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.574 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -63.28 -39.32 94.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.706 -0.225 . . . . 0.0 110.548 -179.867 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.95 -28.27 61.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.131 -179.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -64.15 -52.32 59.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.664 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -85.18 -16.17 41.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.927 -179.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.0 44.64 22.52 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.98 -179.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.6 m -141.77 56.74 1.5 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.192 -177.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.538 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.1 OUTLIER -108.76 146.03 34.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.663 179.131 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 m -69.55 156.88 38.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.891 179.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -28.57 69.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.968 0.413 . . . . 0.0 111.989 -177.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.536 ' HB2' ' HA ' ' A' ' 4' ' ' SER . 2.5 m-20 -85.25 13.97 5.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.293 -175.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.469 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 46.3 t80 -66.72 -50.5 62.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.094 0.473 . . . . 0.0 110.637 -177.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.479 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -70.63 -28.61 64.95 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.104 -178.224 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.52 -52.75 50.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.969 178.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -89.63 -53.74 4.39 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -71.01 -44.37 66.01 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.696 -172.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 36' ' ' THR . 0.2 OUTLIER 58.07 85.1 0.19 Allowed Pre-proline 0 N--CA 1.465 0.323 0 O-C-N 123.712 0.632 . . . . 0.0 112.088 176.861 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.463 -0.267 0 C-N-CA 122.474 2.116 . . . . 0.0 111.501 176.479 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 74.0 m . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 120.814 0.34 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.621 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 44.4 t -83.05 149.87 26.67 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.358 -178.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -162.48 -64.26 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 123.555 0.535 . . . . 0.0 110.179 173.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.81 34.16 4.8 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.422 -173.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.464 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 2.2 mmp_? -98.97 -32.95 11.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.419 0.61 . . . . 0.0 110.149 175.032 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.472 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 1.0 OUTLIER -68.55 -21.69 64.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.416 -175.021 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.58 -27.52 45.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.265 -177.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.95 -50.31 4.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.891 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 135.77 -156.97 23.09 Favored Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 111.296 -0.722 . . . . 0.0 111.296 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.572 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 3.9 t80 -84.29 107.83 16.8 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.132 0.491 . . . . 0.0 110.915 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.446 ' C ' ' H ' ' A' ' 16' ' ' ASP . 0.2 OUTLIER -89.63 93.04 9.32 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.589 173.507 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -78.47 35.97 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.131 0.491 . . . . 0.0 110.885 -176.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.446 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.2 OUTLIER -133.37 2.3 3.53 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.114 177.569 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.407 ' HZ3' ' CG ' ' A' ' 16' ' ' ASP . 5.5 mmpp? -109.08 -169.52 1.5 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.311 -178.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.17 -63.79 1.11 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.452 -178.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.08 138.57 35.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.941 177.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.572 ' HG2' ' CE1' ' A' ' 13' ' ' PHE . 2.3 mp0 -129.08 145.61 51.23 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.271 -174.225 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.2 m -135.57 116.36 14.03 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 168.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -155.04 179.16 9.41 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.449 -0.796 . . . . 0.0 108.994 174.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.58 -22.07 63.56 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 167.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.6 mt -81.24 10.9 4.78 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.367 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -38.13 86.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.739 0.305 . . . . 0.0 110.567 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -26.8 65.65 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.403 179.59 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -77.81 -52.37 9.0 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.377 -176.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -88.25 -16.69 32.52 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.347 -177.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 72.8 mm-40 53.89 54.45 9.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.308 0.575 . . . . 0.0 111.028 -177.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.34 39.51 3.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.766 -178.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.526 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -98.53 147.58 24.62 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.226 -177.25 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.621 ' SG ' ' HB2' ' A' ' 5' ' ' CYS . 1.9 m -77.98 164.13 25.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.164 178.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.62 -38.11 86.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.931 -177.102 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.43 32.88 1.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.21 0.529 . . . . 0.0 110.929 -178.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.472 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 16.8 t80 -72.17 -41.75 66.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.5 0.667 . . . . 0.0 109.676 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -30.09 70.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.236 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.21 -54.63 11.99 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.258 177.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.6 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 46.3 mm-40 -68.73 -53.13 23.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.829 -175.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.509 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 0.5 OUTLIER -73.15 -48.79 32.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.524 -177.805 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.68 61.33 12.6 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.935 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.509 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 64.8 Cg_endo . . . . . 0 N--CA 1.458 -0.603 0 C-N-CA 121.902 1.735 . . . . 0.0 111.526 177.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.521 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.471 ' HB3' ' HG2' ' A' ' 38' ' ' GLU . 30.0 m -112.13 122.07 46.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 176.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.455 ' HE2' ' O ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -146.58 28.91 1.05 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.063 0.459 . . . . 0.0 110.567 -178.501 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 141.97 26.28 0.18 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.799 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.416 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.2 OUTLIER -82.37 -27.38 32.15 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.469 ' HB2' ' OE1' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -70.1 -18.49 63.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.27 0.557 . . . . 0.0 110.208 -179.921 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -107.48 -11.38 15.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.355 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.92 -16.94 14.71 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.067 0.461 . . . . 0.0 110.683 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 112.67 146.05 9.75 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.812 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.557 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 10.0 t80 -56.22 107.36 0.36 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.454 0.645 . . . . 0.0 110.655 178.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.469 HD22 ' HA ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -83.66 81.92 8.54 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.45 179.307 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -1.18 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.053 0.454 . . . . 0.0 110.412 -178.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.56 -9.28 25.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.193 179.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.416 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -96.63 -176.63 3.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.795 0.331 . . . . 0.0 111.344 -176.084 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -82.03 -56.09 4.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.649 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.43 138.23 48.19 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.616 -0.512 . . . . 0.0 109.616 176.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.642 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -127.82 149.63 50.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.278 -171.942 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.416 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 53.8 m -144.92 119.37 9.65 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.343 174.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.475 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 6.8 t0 -153.1 -174.8 5.07 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 169.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -68.29 -21.89 64.76 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 170.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -86.41 14.47 6.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.99 177.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.557 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -59.41 -40.96 88.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.611 178.979 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -26.03 60.64 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.004 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -66.21 -45.64 80.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.63 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -90.91 -17.0 27.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.769 0.319 . . . . 0.0 110.745 178.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 52.81 50.36 18.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.573 -174.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -142.04 48.24 1.6 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.079 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.642 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.64 146.77 24.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.799 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.23 160.77 27.74 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.397 177.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -29.5 70.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.938 -178.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -85.82 28.25 0.8 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.749 0.309 . . . . 0.0 111.234 -179.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -70.51 -47.58 59.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.459 0.647 . . . . 0.0 110.082 -178.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -28.88 66.42 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.997 -178.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.98 -48.96 74.35 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.747 178.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.471 ' HG2' ' HB3' ' A' ' 5' ' ' CYS . 0.3 OUTLIER -87.58 -40.39 14.27 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.484 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.437 ' N ' ' HG3' ' A' ' 38' ' ' GLU . 49.1 t -91.81 -55.57 3.42 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.333 -175.041 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 tttt 47.85 67.41 4.51 Favored Pre-proline 0 N--CA 1.465 0.299 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.119 -173.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo . . . . . 0 C--N 1.343 0.271 0 C-N-CA 122.579 2.186 . . . . 0.0 111.515 179.952 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 121.197 0.522 . . . . 0.0 110.836 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 3.5 t -82.93 118.6 23.58 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.418 -176.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.427 ' HE2' ' O ' ' A' ' 5' ' ' CYS . 13.5 mmtt -141.63 -60.98 0.47 Allowed 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 175.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -128.32 51.68 0.85 Allowed Glycine 0 N--CA 1.444 -0.794 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.851 176.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.525 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -91.71 -21.1 20.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.113 0.482 . . . . 0.0 109.761 177.004 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -76.54 -18.12 58.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.76 -176.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.76 -21.16 41.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.765 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.6 -42.22 6.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.18 -179.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 122.1 179.54 15.97 Favored Glycine 0 N--CA 1.444 -0.768 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 -177.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.718 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 6.6 t80 -62.36 107.11 0.85 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.185 0.517 . . . . 0.0 110.635 177.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.42 ' ND2' ' HB2' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -89.3 84.59 6.48 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.852 176.161 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.45 -14.48 18.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.2 0.524 . . . . 0.0 109.902 -177.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -21.44 54.81 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.224 177.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.42 ' HB2' ' ND2' ' A' ' 14' ' ' ASN . 1.7 mmpp? -84.02 171.2 13.16 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.14 -9.87 37.9 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.117 0.484 . . . . 0.0 110.36 -179.011 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -137.2 138.2 39.93 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 172.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.567 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 26.7 mp0 -131.8 148.03 52.53 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.844 0.354 . . . . 0.0 111.86 -169.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 64.8 m -142.34 118.26 10.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.725 170.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -153.3 -173.7 4.67 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 167.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -19.46 63.74 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 169.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 mt -88.44 14.62 9.3 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.252 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.718 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -60.73 -37.38 81.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.68 0.276 . . . . 0.0 110.776 -178.578 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -26.7 60.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.245 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -68.46 -44.07 75.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.582 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -88.43 -15.75 34.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.406 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.414 ' C ' ' HG ' ' A' ' 30' ' ' SER . 2.6 mm-40 56.8 49.5 14.14 Favored 'General case' 0 CA--C 1.522 -0.1 0 O-C-N 123.713 0.633 . . . . 0.0 110.152 -176.347 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.414 ' HG ' ' C ' ' A' ' 29' ' ' GLN . 12.2 m -151.39 76.47 1.22 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.224 -179.084 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.567 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -118.67 151.5 37.84 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.994 176.179 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 3.3 m -80.11 160.12 25.85 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.91 0.386 . . . . 0.0 110.967 177.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -26.92 68.89 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.142 0.496 . . . . 0.0 111.317 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.61 7.34 36.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.486 -177.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.471 ' CD1' ' HB3' ' A' ' 21' ' ' CYS . 13.5 t80 -62.59 -47.18 84.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.323 0.582 . . . . 0.0 110.123 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -32.97 63.94 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.057 -178.316 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.89 -50.45 34.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.036 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -93.1 -35.63 13.1 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -172.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 69.6 m -97.03 -55.17 2.95 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.428 -177.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 64.95 102.85 0.03 OUTLIER Pre-proline 0 C--O 1.232 0.153 0 O-C-N 123.612 0.57 . . . . 0.0 110.868 179.237 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo . . . . . 0 C--O 1.232 0.188 0 C-N-CA 123.071 2.514 . . . . 0.0 111.998 179.622 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.519 0 CA-C-O 121.387 0.613 . . . . 0.0 111.944 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.417 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 6.1 t -92.49 142.55 27.29 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.687 175.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.426 ' HB2' ' HE2' ' A' ' 6' ' ' LYS . 12.6 mtmm -118.82 -78.02 0.58 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.901 0.382 . . . . 0.0 110.328 178.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -143.19 31.63 1.94 Allowed Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.512 -0.851 . . . . 0.0 111.884 -176.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -82.33 8.95 9.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.867 0.365 . . . . 0.0 111.188 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.459 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 25.9 m -74.66 -16.69 60.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.44 0.638 . . . . 0.0 109.563 176.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -110.1 10.8 23.96 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.286 -177.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -110.45 11.92 23.07 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.697 0.761 . . . . 0.0 109.439 175.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.93 161.4 32.22 Favored Glycine 0 N--CA 1.445 -0.764 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.2 -177.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -73.56 107.2 5.69 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.287 175.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.437 HD22 ' HA ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -83.81 112.18 19.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.023 178.363 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -90.57 3.51 6.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.023 0.44 . . . . 0.0 110.555 -177.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -138.73 53.45 1.77 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.233 0.54 . . . . 0.0 110.88 177.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.437 ' CG ' ' HB2' ' A' ' 14' ' ' ASN . 6.8 mmmm -129.51 -171.3 2.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.8 172.4 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.2 -58.42 4.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.27 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -132.05 153.41 50.45 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.515 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -126.7 141.7 51.76 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -171.899 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.459 ' HB3' ' SG ' ' A' ' 9' ' ' CYS . 92.7 m -139.15 119.3 13.56 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.875 0.369 . . . . 0.0 110.986 174.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.426 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 19.2 t70 -153.93 -172.96 4.39 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 168.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.37 -23.8 63.79 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 167.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.1 mt -80.5 8.92 6.72 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.346 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -61.13 -39.1 88.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.879 0.371 . . . . 0.0 110.066 179.367 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.85 -26.66 62.45 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.104 178.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -66.85 -42.09 86.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.68 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -96.1 -17.5 20.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.03 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 55.47 47.06 21.87 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.101 0.477 . . . . 0.0 110.941 -175.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.502 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 0.3 OUTLIER -141.94 46.73 1.65 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.183 -178.197 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -95.29 153.71 17.54 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.593 179.815 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.42 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -66.62 156.41 35.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.582 179.08 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -37.71 75.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -172.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -103.39 31.74 4.18 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.982 0.42 . . . . 0.0 110.979 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.583 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 7.9 t80 -62.59 -42.88 99.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.492 0.663 . . . . 0.0 109.265 178.032 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.537 ' O ' ' HD3' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -73.35 -32.4 64.51 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.85 179.724 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.61 -57.62 6.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.527 -178.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -87.17 -41.9 13.4 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.583 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 52.0 t -78.94 -46.8 17.61 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.401 -175.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.537 ' HD3' ' O ' ' A' ' 36' ' ' THR . 0.3 OUTLIER 55.3 75.4 0.6 Allowed Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.891 177.206 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo . . . . . 0 C--N 1.344 0.337 0 C-N-CA 123.451 2.767 . . . . 0.0 112.545 -178.672 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.45 -0.472 0 CA-C-O 121.723 0.773 . . . . 0.0 112.268 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 38.5 t -91.28 125.17 35.96 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.189 177.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.78 4.98 43.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.266 0.555 . . . . 0.0 110.021 177.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . 0.594 ' HA2' ' SG ' ' A' ' 39' ' ' CYS . . . 114.71 55.84 0.38 Allowed Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.561 -174.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.664 ' HG3' ' SG ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -84.08 7.14 19.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.469 0.652 . . . . 0.0 109.953 -178.908 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.481 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 16.4 m -72.34 -3.79 25.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.348 176.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 15.7 p -79.77 -24.61 41.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.474 0.654 . . . . 0.0 109.715 172.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -95.57 -22.8 17.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.493 -177.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.72 177.0 45.46 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 -176.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.692 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 4.0 t80 -72.87 108.39 5.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.145 0.497 . . . . 0.0 110.741 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.553 ' HB3' ' HB2' ' A' ' 17' ' ' LYS . 7.6 t-20 -96.74 106.97 19.35 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 172.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -75.49 -3.77 5.26 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.228 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -94.11 -6.86 44.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.752 176.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.553 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -94.69 159.95 14.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.843 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.583 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -84.53 -34.24 23.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.774 0.321 . . . . 0.0 110.567 -174.85 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -120.0 138.44 53.49 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 171.218 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.576 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 22.1 mp0 -127.01 140.89 51.97 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.735 -173.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.664 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -135.1 115.59 13.61 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.171 167.429 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.59 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 24.8 t70 -155.78 179.35 9.28 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.031 173.095 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -68.63 -26.76 65.51 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 168.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mt -76.95 5.89 7.18 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.466 177.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.692 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -61.34 -38.44 86.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.828 0.346 . . . . 0.0 110.547 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.99 -27.51 64.76 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.914 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -70.7 -46.87 62.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.903 -178.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -88.21 -12.79 42.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.658 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 55.17 47.67 21.21 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 121.639 0.733 . . . . 0.0 109.643 -174.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.447 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 16.5 m -145.12 77.76 1.53 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.189 -177.192 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -126.8 151.18 48.63 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.333 175.378 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.6 m -73.85 141.43 46.13 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 172.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -31.59 64.08 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -174.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.42 21.93 1.36 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.444 -177.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.481 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 19.2 t80 -67.99 -49.37 62.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.301 0.572 . . . . 0.0 110.324 -177.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.6 -29.98 62.72 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.648 -176.427 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.87 -45.79 66.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.517 177.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -89.02 -53.91 4.37 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -174.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.594 ' SG ' ' HA2' ' A' ' 7' ' ' GLY . 1.4 m -76.2 -40.21 52.84 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.365 -175.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.76 92.05 0.07 OUTLIER Pre-proline 0 N--CA 1.464 0.237 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.386 175.258 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.458 -0.611 0 C-N-CA 123.028 2.486 . . . . 0.0 111.365 175.179 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.328 0 CA-C-O 121.016 0.436 . . . . 0.0 111.649 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.785 ' SG ' ' HB2' ' A' ' 32' ' ' CYS . 84.0 m -97.55 162.83 13.11 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 168.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.48 -101.3 0.09 Allowed 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.851 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -96.13 4.79 65.33 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.217 -0.753 . . . . 0.0 111.217 -177.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 5.5 ptt-85 -79.61 66.77 5.18 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 122.063 0.935 . . . . 0.0 108.988 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.454 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -148.11 10.87 0.91 Allowed 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.744 166.685 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -145.9 9.93 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.59 177.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.87 -27.49 11.69 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.75 -175.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 119.2 145.49 7.65 Favored Glycine 0 N--CA 1.444 -0.832 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 -173.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.675 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 12.9 t80 -69.91 107.37 3.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 121.312 0.577 . . . . 0.0 110.716 -174.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.416 ' C ' ' H ' ' A' ' 16' ' ' ASP . 0.1 OUTLIER -84.55 97.62 9.68 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.421 174.41 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -87.32 28.83 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.216 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.416 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.2 OUTLIER -135.87 19.58 3.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.515 -175.368 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.89 -176.1 2.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.605 179.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.93 -60.39 2.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.4 t -100.26 138.88 36.73 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 172.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.563 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.1 mp0 -108.6 135.35 50.0 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.923 0.392 . . . . 0.0 110.279 -175.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.518 ' SG ' ' HD1' ' A' ' 35' ' ' TYR . 0.8 OUTLIER -156.3 122.23 4.94 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.946 175.127 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.454 ' HA ' ' HA ' ' A' ' 9' ' ' CYS . 3.4 t70 -155.83 -169.03 2.96 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 160.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -14.53 62.96 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.181 0.515 . . . . 0.0 110.154 174.092 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.78 12.38 30.22 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.227 179.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.675 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -54.57 -40.45 68.79 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.634 0.254 . . . . 0.0 111.309 178.861 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -37.38 78.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.917 0.389 . . . . 0.0 111.028 -179.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -62.54 -48.31 80.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.679 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -81.83 -15.7 53.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.108 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.408 ' C ' ' HG ' ' A' ' 30' ' ' SER . 0.8 OUTLIER 56.09 47.65 19.21 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.506 0.669 . . . . 0.0 110.334 -176.609 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.408 ' HG ' ' C ' ' A' ' 29' ' ' GLN . 9.0 m -150.68 77.21 1.28 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.971 -177.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.563 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -125.9 157.26 38.15 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.27 174.994 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.785 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 2.6 m -71.02 158.84 35.81 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 174.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.12 -29.69 69.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.965 -173.218 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -94.38 32.97 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.483 0.658 . . . . 0.0 111.047 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.518 ' HD1' ' SG ' ' A' ' 21' ' ' CYS . 45.6 t80 -62.18 -38.72 90.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.583 179.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.541 ' O ' ' HA ' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -69.96 -29.01 66.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.986 -179.814 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.72 -45.73 67.54 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.143 0.497 . . . . 0.0 111.006 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -82.11 -51.33 8.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.084 -175.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.6 t -75.65 -41.35 54.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.912 0.387 . . . . 0.0 110.206 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 63.19 66.59 1.16 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.277 -0.874 . . . . 0.0 113.038 175.875 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo . . . . . 0 N--CA 1.455 -0.764 0 C-N-CA 122.205 1.937 . . . . 0.0 110.617 170.176 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.442 -0.857 0 CA-C-O 121.03 0.443 . . . . 0.0 110.074 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.453 ' SG ' ' HB2' ' A' ' 32' ' ' CYS . 0.0 OUTLIER -64.94 120.84 13.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.739 -178.975 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.66 -70.7 0.76 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 173.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.26 61.15 0.63 Allowed Glycine 0 N--CA 1.439 -1.113 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.364 177.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.8 ptp180 -130.62 8.27 4.92 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.837 0.351 . . . . 0.0 110.176 175.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.719 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 83.5 m -103.18 19.55 19.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.634 0.731 . . . . 0.0 109.486 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.84 -46.7 1.97 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.069 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.54 -54.18 46.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.84 174.08 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 149.88 175.39 22.04 Favored Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 121.058 -0.592 . . . . 0.0 111.765 -179.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.577 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 30.0 t80 -65.81 113.91 4.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.163 0.506 . . . . 0.0 111.185 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.596 HD22 ' HA ' ' A' ' 20' ' ' GLN . 0.7 OUTLIER -81.89 116.04 21.36 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.667 172.125 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -97.85 -11.34 8.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-O 121.439 0.637 . . . . 0.0 109.398 177.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -33.92 37.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.38 179.184 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.432 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 3.1 mmtm -70.69 -178.64 1.9 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.167 0.508 . . . . 0.0 111.96 -174.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.82 -47.25 7.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.725 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -109.55 139.49 44.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.491 174.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.692 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -123.2 142.16 51.2 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 120.826 0.346 . . . . 0.0 111.385 -174.089 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.719 ' HB3' ' SG ' ' A' ' 9' ' ' CYS . 1.3 m -145.82 115.9 7.42 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.048 172.385 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.613 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 21.3 t70 -156.39 -176.95 6.24 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.6 -33.92 75.97 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 166.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.63 5.24 3.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.884 178.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.613 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -64.33 -33.63 76.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 -179.631 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.09 -25.92 64.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.783 178.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -73.19 -34.18 65.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.942 -178.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -102.9 -16.39 15.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.673 0.273 . . . . 0.0 111.134 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 59.11 36.47 24.13 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.397 -178.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -133.07 51.84 2.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.404 -177.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.692 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -97.51 148.27 23.41 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.338 177.902 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.453 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 1.8 m -74.53 162.22 29.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.658 178.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.46 -25.19 67.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.929 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.37 12.06 9.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.66 -176.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.442 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 31.0 t80 -63.53 -50.28 70.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.558 0.694 . . . . 0.0 110.754 -176.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -29.52 62.17 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.326 -176.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.69 -54.51 18.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.089 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -84.06 -53.27 5.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 0.0 112.034 -174.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.8 m -77.7 -47.95 17.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.182 -171.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.94 73.09 0.89 Allowed Pre-proline 0 N--CA 1.465 0.316 0 O-C-N 123.541 0.525 . . . . 0.0 111.395 178.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo . . . . . 0 C--N 1.343 0.28 0 C-N-CA 122.561 2.174 . . . . 0.0 112.223 -179.135 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.35 0 CA-C-O 120.952 0.406 . . . . 0.0 111.2 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.455 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 4.7 t -99.34 169.3 9.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.365 178.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.545 ' HG3' ' N ' ' A' ' 7' ' ' GLY . 0.5 OUTLIER 176.96 -36.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.844 175.149 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . 0.545 ' N ' ' HG3' ' A' ' 6' ' ' LYS . . . -147.89 62.27 0.44 Allowed Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.832 -0.699 . . . . 0.0 111.955 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.61 ' HG3' ' SG ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -120.91 -40.14 2.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.99 0.424 . . . . 0.0 110.022 174.253 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.4 m -64.26 -19.66 65.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.256 0.551 . . . . 0.0 110.4 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -81.27 -15.08 56.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.64 -178.004 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.93 -4.75 9.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.738 -176.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.7 -175.16 51.98 Favored Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 111.321 -0.712 . . . . 0.0 111.321 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -69.4 109.74 4.34 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.224 0.535 . . . . 0.0 111.619 -177.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.426 ' C ' ' H ' ' A' ' 16' ' ' ASP . 1.3 t30 -92.21 102.07 14.58 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.088 169.257 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -78.32 47.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.962 0.886 . . . . 0.0 109.968 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -138.09 -35.42 0.63 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.771 -179.108 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.526 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -71.13 166.93 20.39 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.652 -174.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.3 -37.13 16.24 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.861 -175.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -103.98 137.63 41.68 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 172.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.531 ' HB2' ' O ' ' A' ' 30' ' ' SER . 24.2 mp0 -121.63 121.79 38.16 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.243 -173.5 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.61 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -139.57 115.45 10.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.993 0.425 . . . . 0.0 110.116 170.599 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -155.99 -175.17 5.29 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -68.75 -32.36 72.07 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 165.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.7 mt -78.68 7.39 6.96 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.816 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.17 -33.8 76.88 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -26.86 62.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.588 178.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.422 ' HD2' ' CE1' ' A' ' 28' ' ' TYR . 35.7 t80 -67.97 -43.8 78.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.607 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.422 ' CE1' ' HD2' ' A' ' 27' ' ' TYR . 93.8 m-85 -86.29 -16.06 38.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.848 0.356 . . . . 0.0 110.551 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 60.82 38.58 17.88 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.603 -178.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 5.7 m -145.5 72.85 1.33 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.316 -177.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.431 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -101.09 156.94 17.12 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.164 177.161 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 58.7 m -62.88 144.94 56.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.549 175.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.91 -26.98 67.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.184 178.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.05 26.57 7.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.76 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.478 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 11.6 t80 -65.93 -38.34 88.41 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.509 0.671 . . . . 0.0 109.633 -177.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.15 -33.77 63.63 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.184 178.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.61 -50.17 39.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.84 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -87.81 -45.97 9.85 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.149 -173.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.478 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 35.3 t -88.28 -37.08 16.32 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.915 -0.314 . . . . 0.0 111.06 -173.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt 62.46 84.6 0.19 Allowed Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 112.659 0.615 . . . . 0.0 112.659 172.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo . . . . . 0 CA--C 1.534 0.525 0 C-N-CA 123.134 2.556 . . . . 0.0 112.385 175.458 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 11.7 t70 . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.679 0.276 . . . . 0.0 110.683 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 15.2 mp0 -77.54 51.99 0.94 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.223 0.535 . . . . 0.0 111.823 -174.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.418 ' HB3' ' HD3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -114.64 16.6 17.5 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 174.147 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.69 164.51 9.7 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.481 -178.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.48 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 1.2 m -91.99 128.3 37.78 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-O 120.959 0.409 . . . . 0.0 111.356 -178.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.93 -99.02 0.34 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.884 175.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.68 6.84 74.23 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.948 -177.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.545 ' HA ' ' OE1' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -85.94 45.54 1.23 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.147 0.498 . . . . 0.0 110.078 -176.423 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.3 t -133.76 17.06 3.91 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.603 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.73 -38.01 2.42 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.588 -176.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.545 ' OE1' ' HA ' ' A' ' 8' ' ' ARG . 2.4 pm0 -72.92 -26.58 61.45 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.818 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 126.59 175.07 14.01 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.654 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -68.5 116.04 8.6 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.9 0.381 . . . . 0.0 111.334 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.47 97.84 6.57 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 170.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -80.07 -2.86 5.77 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-O 121.304 0.573 . . . . 0.0 109.644 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -119.79 46.79 1.86 Allowed 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.384 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.58 172.11 12.29 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 171.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.418 ' HD3' ' HB3' ' A' ' 3' ' ' GLU . 0.0 OUTLIER -80.13 -21.79 42.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.225 0.536 . . . . 0.0 110.171 178.974 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 t -149.18 138.48 21.54 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.027 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.565 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -130.68 151.98 50.53 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -168.151 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.5 m -142.46 120.13 11.83 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.573 172.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.521 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 28.7 t0 -154.31 -179.54 8.03 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 170.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.62 -22.54 65.33 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 167.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.6 mt -85.53 14.21 5.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.119 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.521 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -61.23 -39.3 89.8 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 178.707 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.29 -25.96 59.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.799 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -67.5 -47.83 68.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.731 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -90.04 -16.06 30.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.641 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.445 ' C ' ' HG ' ' A' ' 30' ' ' SER . 21.7 mt-30 58.86 50.53 8.43 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.423 0.63 . . . . 0.0 110.085 -173.034 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.445 ' HG ' ' C ' ' A' ' 29' ' ' GLN . 0.7 OUTLIER -147.92 78.22 1.44 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.506 -177.358 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.565 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.1 OUTLIER -127.73 147.42 50.4 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.325 175.162 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 5' ' ' CYS . 4.1 m -73.84 169.42 17.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.156 0.503 . . . . 0.0 111.741 178.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.65 -28.27 64.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.471 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.48 ' OD1' ' HB2' ' A' ' 5' ' ' CYS . 0.4 OUTLIER -89.56 17.05 6.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.763 0.316 . . . . 0.0 110.772 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -67.11 -48.03 69.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.564 0.697 . . . . 0.0 109.579 178.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -29.72 64.22 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.752 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.99 -57.79 4.59 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.388 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.429 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 24.5 mm-40 -78.96 -42.6 26.41 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -173.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.1 t -84.12 -55.4 4.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.363 -174.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 mttt 61.52 76.16 0.41 Allowed Pre-proline 0 N--CA 1.467 0.408 0 CA-C-O 121.103 0.478 . . . . 0.0 110.429 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -75.02 -12.04 21.46 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.67 2.246 . . . . 0.0 113.402 -174.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 64.46 71.19 0.48 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.004 0.43 . . . . 0.0 110.729 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.54 HG11 ' HA2' ' A' ' 46' ' ' GLY . 2.6 t -79.08 86.33 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 120.989 0.424 . . . . 0.0 110.779 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -77.21 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.882 -177.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.21 -12.31 59.65 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.533 -174.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.54 ' HA2' HG11 ' A' ' 43' ' ' VAL . . . 76.91 -90.12 0.97 Allowed Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.479 -0.867 . . . . 0.0 111.464 -175.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.0 t70 . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.228 -0.892 . . . . 0.0 109.384 176.45 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -99.06 105.85 18.02 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 174.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.446 ' OE1' ' HD3' ' A' ' 18' ' ' LYS . 7.8 mm-40 -86.61 114.32 23.23 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.264 0.554 . . . . 0.0 111.41 -174.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.84 142.53 50.39 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.469 175.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.625 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -86.27 121.69 29.2 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.804 -178.065 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -151.51 -88.32 0.06 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.461 -0.791 . . . . 0.0 108.999 176.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.46 34.43 2.9 Favored Glycine 0 N--CA 1.451 -0.366 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.136 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.49 ' HA ' ' HG2' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -128.13 10.54 6.38 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.831 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.615 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 4.0 t -115.0 -11.29 12.15 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 173.34 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.88 -6.06 20.53 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.191 -177.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.49 ' HG2' ' HA ' ' A' ' 8' ' ' ARG . 22.0 pt-20 -105.05 -14.56 15.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.988 -177.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.21 149.94 25.86 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.915 -176.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.435 ' CE2' ' HG2' ' A' ' 20' ' ' GLN . 2.6 t80 -56.94 109.12 0.59 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.11 0.481 . . . . 0.0 111.869 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.5 ' C ' ' H ' ' A' ' 16' ' ' ASP . 54.7 t30 -99.98 113.46 26.05 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 170.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.2 t -78.83 39.08 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.818 0.818 . . . . 0.0 110.509 -177.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.5 ' H ' ' C ' ' A' ' 14' ' ' ASN . 24.5 t0 -151.35 29.19 0.63 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.036 173.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.573 ' HB2' HE22 ' A' ' 20' ' ' GLN . 7.0 mmtp -110.09 155.06 22.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.468 175.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.446 ' HD3' ' OE1' ' A' ' 3' ' ' GLU . 0.0 OUTLIER -64.13 -74.09 0.11 Allowed 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.324 0.39 . . . . 0.0 111.032 178.846 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -102.4 154.97 18.57 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 174.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.573 HE22 ' HB2' ' A' ' 17' ' ' LYS . 1.1 tp-100 -138.62 146.71 42.05 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -171.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.615 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 39.8 m -140.56 117.69 11.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.21 -0.904 . . . . 0.0 108.866 168.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.533 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 10.7 t70 -154.76 179.4 9.12 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -69.38 -35.11 75.48 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 165.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 40.7 mt -74.93 2.29 10.73 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.393 178.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.533 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -63.72 -33.74 76.32 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 178.218 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -36.12 63.09 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.128 0.489 . . . . 0.0 110.488 176.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -62.76 -46.45 87.98 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.431 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -89.44 -8.74 52.37 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.338 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 52.91 47.22 25.15 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.201 0.524 . . . . 0.0 111.473 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.4 m -148.06 73.41 1.26 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.604 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -120.15 152.08 38.16 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.852 0.358 . . . . 0.0 110.883 177.216 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.489 ' SG ' ' SG ' ' A' ' 5' ' ' CYS . 1.6 m -76.34 159.06 30.88 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.101 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -25.87 67.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.012 0.434 . . . . 0.0 111.515 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.2 15.62 4.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.798 -177.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.437 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 23.3 t80 -65.79 -50.8 63.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.425 0.631 . . . . 0.0 110.162 -177.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.13 -29.5 62.94 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.048 -176.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.86 -49.91 59.47 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.212 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.625 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 31.1 mm-40 -84.35 -51.38 7.01 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.26 -0.427 . . . . 0.0 112.15 -174.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.09 -42.55 23.41 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.852 -175.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.18 56.32 14.1 Favored Pre-proline 0 N--CA 1.469 0.475 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 177.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -85.65 -15.76 4.89 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.22 1.946 . . . . 0.0 112.726 -178.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -105.41 100.55 10.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.035 0.445 . . . . 0.0 110.377 -177.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 t -76.18 109.77 10.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.431 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.19 94.3 2.94 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.371 -178.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -71.69 0.32 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.14 176.145 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 104.85 120.53 4.77 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.599 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 t70 . . . . . 0 C--O 1.246 0.909 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.132 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 34.0 p-10 . . . . . 0 N--CA 1.481 1.12 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -158.85 18.04 0.19 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.987 0.422 . . . . 0.0 110.868 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -74.85 83.99 2.18 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.282 -176.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m -73.86 132.54 42.63 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.621 176.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.588 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -71.09 149.52 46.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.635 -175.387 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -144.48 -104.42 0.11 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.138 173.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -89.72 37.5 3.34 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.961 -0.638 . . . . 0.0 113.438 -173.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.539 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -74.18 -26.39 60.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.003 0.43 . . . . 0.0 110.025 177.54 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.412 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 0.8 OUTLIER -72.71 -23.85 60.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.754 -174.676 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.64 -36.13 16.43 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.906 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -71.36 -43.33 67.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.274 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 119.65 175.03 15.76 Favored Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 111.364 -0.694 . . . . 0.0 111.364 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.41 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 4.2 t80 -76.02 107.63 8.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.166 0.508 . . . . 0.0 110.515 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -93.23 100.79 13.09 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.737 174.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.3 t -77.44 52.23 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.853 0.835 . . . . 0.0 110.457 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -151.67 -30.66 0.16 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.188 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.532 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -77.02 163.43 26.69 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.17 176.278 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -77.61 -62.9 1.51 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.245 -171.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.74 138.61 34.04 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.569 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -130.86 142.91 50.41 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.703 -173.086 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 92.6 m -135.72 118.01 15.62 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 170.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.448 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 14.9 t70 -153.77 178.54 9.77 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 177.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.81 -25.87 63.98 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 166.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.432 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 0.3 OUTLIER -80.74 14.32 2.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.511 176.205 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.448 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -63.46 -47.52 81.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.551 -178.739 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.72 -25.61 66.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.224 0.535 . . . . 0.0 110.928 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.432 ' HB3' ' O ' ' A' ' 24' ' ' LEU . 78.0 t80 -63.29 -39.03 93.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.784 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -105.01 -16.44 14.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.414 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 58.1 38.78 26.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.284 0.564 . . . . 0.0 110.717 -177.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.4 m -127.57 41.47 3.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.761 -177.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.569 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.88 150.1 21.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.624 -179.538 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.0 m -73.24 154.11 40.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.333 177.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.87 -37.45 79.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.92 0.391 . . . . 0.0 111.773 -178.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.14 40.22 1.04 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.593 0.711 . . . . 0.0 110.889 -179.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.421 ' HD1' ' SG ' ' A' ' 21' ' ' CYS . 19.8 t80 -70.87 -42.78 69.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.688 178.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -31.8 72.97 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.354 -178.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.88 -43.56 79.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.804 -178.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 63.7 mm-40 -95.0 -37.59 11.06 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -173.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.9 t -82.38 -48.86 10.65 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.367 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 47.93 62.86 11.26 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.102 -177.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -74.72 6.71 3.11 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.694 2.263 . . . . 0.0 113.299 -171.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 64.44 79.49 0.25 Allowed 'General case' 0 C--O 1.235 0.334 0 O-C-N 123.468 0.48 . . . . 0.0 110.717 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 87.9 t -70.72 111.0 4.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.67 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.57 144.34 35.82 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.886 -174.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -119.83 133.01 55.74 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 173.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -59.42 -60.55 8.59 Favored Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.003 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.8 t70 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.434 -0.793 . . . . 0.0 109.95 176.938 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 121.371 0.605 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -148.01 23.68 1.07 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.611 -178.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.445 ' HA ' ' CB ' ' A' ' 19' ' ' CYS . 0.9 OUTLIER -97.09 47.52 1.04 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.968 -176.312 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -141.2 141.54 34.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.23 177.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.504 ' HA ' ' HG3' ' A' ' 8' ' ' ARG . 30.3 m -100.29 131.85 45.99 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.439 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.13 -68.63 0.87 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.13 0.49 . . . . 0.0 109.839 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -115.32 29.89 7.05 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 178.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.504 ' HG3' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -96.66 61.3 1.89 Allowed 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 -176.204 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -166.92 45.25 0.06 Allowed 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.34 -1.3 . . . . 0.0 109.323 171.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -163.86 -37.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.205 -175.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -77.63 -31.06 52.57 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.783 -176.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 115.41 162.02 13.32 Favored Glycine 0 N--CA 1.439 -1.131 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -170.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -59.25 114.37 2.6 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 117.145 0.472 . . . . 0.0 111.389 -175.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -77.88 85.86 4.12 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.734 174.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -71.73 -6.45 7.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 121.263 0.554 . . . . 0.0 109.627 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.13 -32.48 50.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.82 174.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.537 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -72.3 172.71 9.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.411 0.624 . . . . 0.0 112.094 -168.452 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.49 -51.28 5.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.307 -179.037 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.445 ' CB ' ' HA ' ' A' ' 3' ' ' GLU . 4.6 t -103.63 138.4 40.34 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 169.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.713 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.8 mm-40 -118.98 132.44 56.07 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.469 0.652 . . . . 0.0 112.652 -167.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.59 119.49 14.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.625 169.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.43 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 5.9 t70 -156.64 -168.78 2.79 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 165.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.19 -29.31 70.68 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.736 0.779 . . . . 0.0 108.952 169.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.07 14.66 10.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.667 -178.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.43 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -62.22 -37.99 87.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.623 0.249 . . . . 0.0 110.862 -178.61 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.85 -26.7 63.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.934 0.397 . . . . 0.0 111.011 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -67.42 -36.32 81.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.943 -178.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -100.72 -15.69 17.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.91 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 53.53 58.54 5.08 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.075 -178.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.7 m -148.77 48.42 1.01 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.472 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.713 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.63 138.08 34.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.908 0.385 . . . . 0.0 111.397 -176.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.13 162.23 28.69 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.837 177.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -27.22 68.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.257 0.551 . . . . 0.0 111.018 177.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.87 -10.29 59.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.37 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.437 ' CE2' ' HG3' ' A' ' 41' ' ' PRO . 31.7 t80 -67.33 -46.66 72.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.361 0.601 . . . . 0.0 110.048 -176.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.61 -29.35 62.32 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.64 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.87 -50.42 42.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.429 178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.422 ' OE1' ' HA ' ' A' ' 38' ' ' GLU . 4.9 mm-40 -88.71 -43.26 11.43 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -173.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.0 t -84.33 -42.96 15.24 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.592 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.93 65.36 3.35 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.251 178.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.437 ' HG3' ' CE2' ' A' ' 35' ' ' TYR . 87.8 Cg_endo -77.82 -18.77 13.06 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.375 2.05 . . . . 0.0 111.017 175.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -135.03 110.61 9.17 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.047 -0.979 . . . . 0.0 109.601 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.2 t -85.93 149.24 4.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.55 176.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.05 130.73 45.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.475 178.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -81.34 162.05 23.58 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.693 0.282 . . . . 0.0 110.286 -178.054 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -136.06 145.97 17.94 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.415 -177.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.2 t70 . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.326 -0.845 . . . . 0.0 110.311 -178.383 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . 0.448 ' O ' ' HB3' ' A' ' 2' ' ' GLN . 9.8 t70 . . . . . 0 N--CA 1.479 1.017 0 CA-C-O 120.803 0.335 . . . . 0.0 110.477 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.475 ' HG2' ' HG3' ' A' ' 3' ' ' GLU . 0.2 OUTLIER 170.74 -31.23 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.237 -0.892 . . . . 0.0 108.75 179.341 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.768 ' HA ' ' HB2' ' A' ' 19' ' ' CYS . 0.9 OUTLIER -100.07 41.53 1.16 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.065 -0.97 . . . . 0.0 108.697 173.972 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -128.99 123.12 31.6 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.62 -178.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -85.44 138.33 32.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.794 -176.65 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -125.9 -52.1 1.56 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 173.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -166.22 43.26 0.27 Allowed Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.662 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.41 ' HD2' ' SG ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -95.44 12.42 29.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.412 0.625 . . . . 0.0 109.99 177.925 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -79.89 -2.59 44.3 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.433 179.624 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.94 -1.78 18.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.346 -178.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -98.49 -8.78 26.07 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.719 0.295 . . . . 0.0 110.743 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.68 162.32 35.96 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.138 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.577 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 4.5 t80 -74.77 106.87 6.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.278 0.561 . . . . 0.0 110.438 177.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.448 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -99.85 102.27 13.64 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.099 174.523 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -78.54 41.13 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.12 0.486 . . . . 0.0 110.758 -175.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.407 ' H ' ' C ' ' A' ' 14' ' ' ASN . 6.8 t0 -166.69 24.32 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.033 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.448 ' HG2' ' HB3' ' A' ' 14' ' ' ASN . 9.0 mmtm -89.3 -103.44 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.175 0.512 . . . . 0.0 110.228 176.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.429 ' HG3' ' C ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -150.48 -56.06 0.16 Allowed 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.161 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.768 ' HB2' ' HA ' ' A' ' 3' ' ' GLU . 1.8 t -124.84 147.76 48.58 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.465 171.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.626 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 2.7 mp0 -125.32 131.66 53.0 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.898 0.38 . . . . 0.0 111.679 -171.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.457 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 11.4 m -137.88 118.98 14.42 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 170.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -152.1 -170.62 3.69 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -69.05 -30.92 69.36 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 167.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mt -85.66 14.99 5.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.843 -178.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.577 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -63.55 -39.49 94.54 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 178.401 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.99 -28.52 62.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.833 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -65.49 -47.37 76.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.708 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -89.33 -11.97 41.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.008 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 53.81 43.78 30.49 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.175 0.512 . . . . 0.0 110.516 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 m -139.55 58.59 1.61 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.874 -176.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.626 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -110.48 156.0 21.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.329 177.096 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.6 m -72.48 156.2 39.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.491 177.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -22.34 66.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.988 -177.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.46 21.48 12.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.107 -177.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.487 ' O ' ' HB2' ' A' ' 39' ' ' CYS . 20.8 t80 -60.82 -50.96 71.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.119 0.485 . . . . 0.0 110.683 -177.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.457 ' O ' ' HE2' ' A' ' 40' ' ' LYS . 0.8 OUTLIER -72.98 -30.27 63.68 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.381 -177.383 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.72 -46.33 66.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.655 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 71.6 mm-40 -95.86 -39.99 9.54 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -173.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 96.0 m -82.43 -44.45 16.05 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.808 -178.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.457 ' HE2' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 59.32 78.0 0.36 Allowed Pre-proline 0 CA--C 1.531 0.221 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.147 179.851 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -63.31 -21.38 71.74 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.829 2.353 . . . . 0.0 112.589 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 56.53 48.38 16.8 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.09 177.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 p -99.51 123.69 52.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.262 0.553 . . . . 0.0 110.89 -178.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.43 -157.57 0.16 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.422 177.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.437 ' HA ' ' HD3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -140.65 113.67 8.39 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 121.84 -0.538 . . . . 0.0 111.763 -178.387 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -92.41 104.65 3.2 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 110.934 -0.866 . . . . 0.0 110.934 172.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.1 t70 . . . . . 0 C--O 1.251 1.144 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.378 -177.682 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . 0.437 ' H1 ' ' CD ' ' A' ' 3' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.714 0.292 . . . . 0.0 110.758 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.86 23.41 8.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.341 0.591 . . . . 0.0 110.053 179.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.437 ' CD ' ' H1 ' ' A' ' 1' ' ' ASP . 16.5 mp0 -96.54 2.95 52.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.978 -177.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.85 118.2 28.39 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.315 -179.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.541 ' H ' ' HB2' ' A' ' 34' ' ' ASP . 3.1 t -85.48 143.24 28.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.537 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.34 -89.83 0.51 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.851 0.358 . . . . 0.0 110.064 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.98 47.12 1.04 Allowed Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.711 -0.757 . . . . 0.0 111.646 178.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.475 ' HB2' ' NH1' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.27 8.23 36.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.112 0.482 . . . . 0.0 110.341 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.3 -15.04 48.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.35 0.595 . . . . 0.0 109.96 177.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.36 -10.12 59.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.177 -178.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -102.15 -5.89 23.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.546 178.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 79.15 -177.56 54.16 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.266 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -72.11 108.55 5.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.02 0.438 . . . . 0.0 110.798 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.46 ' C ' ' H ' ' A' ' 16' ' ' ASP . 2.0 t30 -99.14 105.57 17.66 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.583 172.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -78.8 41.28 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.667 0.746 . . . . 0.0 110.157 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.46 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -128.35 -20.87 3.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.056 -0.974 . . . . 0.0 110.128 178.391 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.454 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 29.8 mmtm -91.31 -175.02 4.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.218 0.532 . . . . 0.0 111.495 -173.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.471 ' H ' ' HD2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -87.5 -69.52 0.68 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.248 -177.624 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.27 139.19 35.29 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 174.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.57 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -126.32 148.84 49.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.815 0.34 . . . . 0.0 110.886 -175.813 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 69.1 m -133.8 116.59 15.88 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 171.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.402 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 14.4 t70 -154.12 178.0 10.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.182 176.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.96 -27.21 64.55 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 168.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 54.1 mt -82.46 14.7 2.88 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.406 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.405 ' HB2' ' HB3' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -58.63 -40.68 84.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.702 0.287 . . . . 0.0 110.743 -179.584 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -25.9 59.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.032 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -64.83 -49.4 70.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.584 -178.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -88.68 -15.92 33.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.844 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.69 48.85 5.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.308 -176.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 44.0 m -149.13 73.21 1.2 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.763 -178.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.57 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -114.42 149.01 36.86 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.021 177.004 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -75.63 152.76 37.57 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 175.934 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.85 -33.52 74.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -174.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.541 ' HB2' ' H ' ' A' ' 5' ' ' CYS . 0.8 OUTLIER -86.58 24.52 1.41 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.593 -176.568 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.489 ' O ' ' HB2' ' A' ' 39' ' ' CYS . 19.5 t80 -67.27 -50.72 59.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.231 0.539 . . . . 0.0 110.455 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.492 ' O ' ' HE3' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -73.65 -30.59 63.02 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.347 -175.783 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.69 -53.52 18.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.505 -178.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -90.76 -37.76 13.46 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -172.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.489 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 73.6 m -82.08 -55.93 4.26 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.179 -176.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.492 ' HE3' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 60.64 79.81 0.28 Allowed Pre-proline 0 N--CA 1.463 0.203 0 O-C-N 123.427 0.454 . . . . 0.0 110.904 179.609 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.57 ' HB2' HG23 ' A' ' 43' ' ' VAL . 40.7 Cg_endo -67.89 -5.38 14.37 Favored 'Trans proline' 0 CA--C 1.532 0.386 0 C-N-CA 123.119 2.546 . . . . 0.0 113.333 -176.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 59.59 32.17 21.41 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.008 0.433 . . . . 0.0 111.413 178.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.57 HG23 ' HB2' ' A' ' 41' ' ' PRO . 83.6 t -99.67 106.16 18.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.078 0.466 . . . . 0.0 110.307 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.01 -5.0 55.97 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.267 177.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.8 tpm_? 71.97 -59.32 0.56 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.3 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 97.72 29.6 7.66 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.804 -0.712 . . . . 0.0 111.424 -177.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.1 t70 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.62 -0.705 . . . . 0.0 110.225 -179.158 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 . . . . . 0 N--CA 1.482 1.152 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -151.46 53.06 0.84 Allowed 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 121.385 0.612 . . . . 0.0 111.065 -178.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -92.54 -4.57 53.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.503 0.668 . . . . 0.0 110.193 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.86 132.69 35.75 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.858 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.56 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 1.6 t -87.91 142.82 27.5 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.834 0.35 . . . . 0.0 110.742 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.447 ' HA ' ' HG3' ' A' ' 38' ' ' GLU . 14.4 mmtt -134.58 -79.42 0.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.722 175.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -132.82 59.85 0.68 Allowed Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.025 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.555 ' NH2' ' HB3' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -128.44 28.76 5.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.054 0.454 . . . . 0.0 110.218 178.413 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.1 OUTLIER -110.46 -11.51 14.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.283 177.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.32 -12.48 40.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.506 -177.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -96.91 -18.37 19.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.724 -177.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 118.94 -176.55 16.12 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.473 -177.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.674 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 9.4 t80 -81.73 108.34 15.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.881 0.372 . . . . 0.0 110.62 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -79.14 94.16 5.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.013 174.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -86.11 36.03 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-O 121.286 0.565 . . . . 0.0 110.519 -177.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -138.06 -13.23 1.42 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.823 -176.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 1.0 OUTLIER -92.84 -172.27 2.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.229 0.538 . . . . 0.0 111.963 -170.554 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.21 -17.3 46.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.258 -179.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.555 ' HB3' ' NH2' ' A' ' 8' ' ' ARG . 5.6 t -162.81 142.12 8.94 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.091 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.573 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -127.44 150.97 49.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.78 0.324 . . . . 0.0 111.311 -171.281 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.502 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 86.9 m -142.1 117.73 10.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.271 173.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.445 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 17.5 t70 -153.81 -177.77 6.61 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 171.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -68.61 -28.97 67.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 167.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mt -77.39 12.12 1.68 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.508 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.674 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -57.34 -42.57 82.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.074 179.51 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.44 -27.16 60.48 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.916 0.389 . . . . 0.0 111.084 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -67.41 -44.26 79.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.404 -178.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -90.72 -16.06 29.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.932 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 56.9 54.34 7.21 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.138 -174.102 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.2 m -154.34 76.64 1.04 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.156 -178.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.573 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -125.16 148.48 48.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.505 176.789 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.56 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 5.4 m -70.89 154.37 41.88 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.555 175.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.99 -28.74 69.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.617 -178.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.74 21.56 4.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.045 -178.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -65.36 -47.33 76.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.762 0.792 . . . . 0.0 109.285 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.444 ' O ' ' HE2' ' A' ' 40' ' ' LYS . 0.5 OUTLIER -74.06 -29.71 62.03 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.014 -179.755 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.71 -40.6 76.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.853 -177.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.447 ' HG3' ' HA ' ' A' ' 6' ' ' LYS . 64.8 mm-40 -98.38 -51.01 4.11 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -175.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 4.3 m -73.52 -34.68 65.38 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -177.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.444 ' HE2' ' O ' ' A' ' 36' ' ' THR . 0.2 OUTLIER 52.04 75.54 0.64 Allowed Pre-proline 0 N--CA 1.465 0.287 0 O-C-N 123.66 0.6 . . . . 0.0 112.232 173.892 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.499 ' O ' ' HB2' ' A' ' 42' ' ' GLN . 60.8 Cg_endo -79.17 38.39 0.72 Allowed 'Trans proline' 0 CA--C 1.529 0.264 0 C-N-CA 123.327 2.685 . . . . 0.0 111.748 176.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.499 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 20.1 mt-30 79.56 -44.06 0.3 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.099 0.96 . . . . 0.0 110.796 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.434 ' HB ' ' O ' ' A' ' 42' ' ' GLN . 82.0 t 77.65 121.42 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 O-C-N 124.189 0.931 . . . . 0.0 111.149 176.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.25 117.35 8.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.291 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -91.92 58.78 3.48 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.353 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -144.22 39.88 1.21 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.068 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.4 t70 . . . . . 0 C--O 1.252 1.211 0 CA-C-O 118.554 -0.736 . . . . 0.0 109.987 179.647 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 3.8 t0 . . . . . 0 N--CA 1.483 1.188 0 CA-C-O 121.144 0.497 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -103.97 90.69 3.68 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 176.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.547 ' HG3' ' HB2' ' A' ' 19' ' ' CYS . 0.4 OUTLIER -81.92 -179.4 7.38 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.904 179.394 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.7 m -120.78 140.18 52.06 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.78 -179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.622 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -78.55 127.64 32.43 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.094 178.539 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -98.71 -88.08 0.33 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.324 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.32 49.33 0.92 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 120.678 -0.772 . . . . 0.0 111.979 177.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.622 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 4.8 mmt85 -76.05 -6.83 52.9 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.826 0.346 . . . . 0.0 110.782 -175.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.421 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 23.7 m -79.53 -7.4 58.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.226 -176.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.54 -36.58 10.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.649 0.262 . . . . 0.0 111.062 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.39 -46.97 29.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.988 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 124.02 -178.69 16.37 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.013 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.659 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 4.0 t80 -79.53 108.5 13.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.879 0.371 . . . . 0.0 111.559 -178.134 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -94.44 105.09 17.05 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 168.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 t -64.41 -21.52 29.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.264 0.554 . . . . 0.0 109.916 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -94.54 41.04 1.09 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.074 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.416 ' HA ' ' HD2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -119.27 165.55 14.12 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 170.271 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.545 ' HG3' ' OE1' ' A' ' 3' ' ' GLU . 0.0 OUTLIER -87.64 -19.51 27.62 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.336 0.589 . . . . 0.0 110.143 -176.119 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.547 ' HB2' ' HG3' ' A' ' 3' ' ' GLU . 2.7 t -146.55 139.47 25.41 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 175.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.607 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -130.15 142.39 50.59 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -171.053 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.464 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 66.1 m -138.18 117.32 12.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.546 167.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -154.9 179.97 8.61 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 175.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -15.53 63.42 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 166.26 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.8 mt -89.9 0.25 57.17 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.376 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.659 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -66.27 -25.58 66.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.735 0.303 . . . . 0.0 110.802 -176.337 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -39.82 62.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.896 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -63.35 -40.37 97.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.972 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -88.44 -15.44 35.44 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.321 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 54.64 45.28 27.15 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.53 -177.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.27 70.19 1.22 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.185 -178.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.607 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -109.61 148.61 31.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.118 176.154 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 21.1 m -65.29 157.77 28.16 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.931 0.396 . . . . 0.0 111.496 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.38 -26.18 63.6 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.277 0.56 . . . . 0.0 110.85 178.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.61 15.86 13.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.254 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.579 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 16.2 t80 -71.23 -39.46 71.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.699 -178.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -35.27 65.86 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.981 -179.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.07 -48.28 58.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.931 -178.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -90.81 -42.87 10.41 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -174.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.579 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 35.9 t -82.42 -51.94 7.36 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.379 -175.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.429 ' HE3' ' HB2' ' A' ' 40' ' ' LYS . 0.4 OUTLIER 57.72 75.56 0.54 Allowed Pre-proline 0 CA--C 1.531 0.242 0 O-C-N 123.607 0.567 . . . . 0.0 111.151 176.719 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -50.37 -49.44 16.48 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.089 2.526 . . . . 0.0 112.65 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 71.53 -12.01 0.67 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.288 0.635 . . . . 0.0 112.577 175.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -63.2 121.2 11.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.739 0.304 . . . . 0.0 110.519 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -119.52 138.89 52.88 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.403 178.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.3 ttm180 -150.05 113.51 4.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.795 0.331 . . . . 0.0 110.484 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -140.28 -116.44 1.32 Allowed Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.617 177.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.4 t70 . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.256 -0.878 . . . . 0.0 109.363 179.229 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.086 0 CA-C-O 120.925 0.393 . . . . 0.0 111.138 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.46 21.04 0.41 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.909 176.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -86.19 50.08 1.92 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.145 -177.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -136.93 152.01 49.7 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.884 176.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 2.6 t -80.33 138.18 36.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.801 0.334 . . . . 0.0 110.262 -178.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -134.28 -81.79 0.45 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.104 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -112.09 31.93 6.66 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 176.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.655 ' O ' ' HB2' ' A' ' 21' ' ' CYS . 2.9 mtt-85 -86.51 54.07 3.03 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 121.586 0.708 . . . . 0.0 109.87 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 39' ' ' CYS . 0.0 OUTLIER -150.64 18.64 0.81 Allowed 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 167.28 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.69 -36.65 0.21 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.924 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.505 ' HG2' ' HA ' ' A' ' 8' ' ' ARG . 17.2 pt-20 -68.6 -25.07 64.68 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.079 178.107 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 102.7 161.23 25.87 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.246 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.538 ' CE1' ' HG3' ' A' ' 20' ' ' GLN . 3.9 t80 -68.4 119.27 12.63 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.269 0.557 . . . . 0.0 110.607 178.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.527 ' HB3' ' HB2' ' A' ' 17' ' ' LYS . 4.2 t-20 -103.34 104.15 14.23 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.895 175.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -79.47 51.47 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 176.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -157.52 -41.99 0.07 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.671 -1.15 . . . . 0.0 109.475 -174.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.527 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -67.18 126.48 29.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.009 174.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.42 -59.26 1.63 Allowed 'General case' 0 N--CA 1.474 0.767 0 O-C-N 124.014 0.821 . . . . 0.0 113.172 -175.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -100.12 143.84 29.86 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 177.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.637 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.4 mm-40 -131.34 145.17 51.73 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.127 0.489 . . . . 0.0 112.108 -173.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.806 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 1.8 m -136.4 120.22 17.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.441 171.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.419 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 10.4 t70 -154.87 -171.49 3.85 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 172.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.04 -33.03 72.95 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 107.248 -1.389 . . . . 0.0 107.248 162.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.9 mp -77.85 14.39 1.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.557 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -65.59 -37.36 86.4 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 176.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -26.31 62.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.167 0.508 . . . . 0.0 110.582 176.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.4 ' HD2' ' CD2' ' A' ' 28' ' ' TYR . 91.7 t80 -66.34 -39.77 89.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.093 -178.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.4 ' CD2' ' HD2' ' A' ' 27' ' ' TYR . 43.6 m-85 -102.87 -8.68 20.54 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.657 0.265 . . . . 0.0 110.709 177.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 50.68 48.7 22.27 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.771 -177.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.6 m -140.22 54.34 1.63 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.51 -177.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.637 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.95 137.09 36.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.43 -178.316 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.23 151.77 43.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.943 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.9 -27.61 66.87 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -174.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.06 13.4 18.95 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.194 -176.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.806 ' CD1' ' HB3' ' A' ' 21' ' ' CYS . 3.3 t80 -63.86 -48.45 76.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.2 -178.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.07 -31.21 68.69 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.298 -177.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.58 -51.53 27.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.359 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -77.58 -49.52 14.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.983 -174.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 9' ' ' CYS . 1.4 t -85.27 -54.49 4.57 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.85 -175.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 61.28 78.19 0.32 Allowed Pre-proline 0 C--O 1.233 0.225 0 O-C-N 123.49 0.494 . . . . 0.0 110.861 -177.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.24 -15.96 47.3 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.783 2.322 . . . . 0.0 112.313 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 72.5 142.42 0.06 Allowed 'General case' 0 C--O 1.233 0.195 0 O-C-N 124.01 0.819 . . . . 0.0 112.355 177.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -135.16 -172.22 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.008 176.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 m 60.07 63.45 1.43 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.415 0.626 . . . . 0.0 110.554 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.45 147.02 50.64 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.224 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 138.26 157.06 7.32 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.699 177.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.3 t70 . . . . . 0 C--O 1.246 0.905 0 CA-C-O 119.022 -0.513 . . . . 0.0 109.813 177.359 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 120.946 0.403 . . . . 0.0 110.48 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.553 ' O ' ' HB2' ' A' ' 3' ' ' GLU . 0.0 OUTLIER -82.84 163.08 21.41 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 178.568 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.553 ' HB2' ' O ' ' A' ' 2' ' ' GLN . 0.1 OUTLIER 80.42 129.67 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 O-C-N 124.27 0.981 . . . . 0.0 110.179 -176.004 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.68 171.37 14.45 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.059 -0.518 . . . . 0.0 109.632 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.507 ' HB2' ' HB2' ' A' ' 38' ' ' GLU . 87.0 m -65.74 153.45 41.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.432 0.634 . . . . 0.0 111.156 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.51 ' O ' ' HE3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -151.71 31.08 0.57 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.468 0.651 . . . . 0.0 109.397 175.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 80.58 33.4 31.14 Favored Glycine 0 N--CA 1.443 -0.84 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.806 -174.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -4.99 44.23 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.96 0.41 . . . . 0.0 110.288 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.583 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 35.3 m -68.7 1.74 3.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.162 177.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 p -86.26 -24.23 26.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.148 0.499 . . . . 0.0 110.319 176.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -98.76 -6.22 29.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.274 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.91 -166.76 34.13 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.316 -176.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.444 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 15.7 t80 -70.55 108.11 4.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.944 0.402 . . . . 0.0 110.822 178.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -78.23 86.29 4.35 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.416 176.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.8 56.54 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.811 0.815 . . . . 0.0 109.571 177.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -155.01 -41.35 0.09 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.761 -1.109 . . . . 0.0 109.242 -176.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.534 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -76.17 173.02 11.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.846 -179.392 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.431 ' HE3' ' HB2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -85.59 -36.78 20.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.661 -174.718 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -111.5 138.73 47.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.688 174.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.524 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 18.9 mp0 -123.83 138.17 54.54 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.919 0.39 . . . . 0.0 111.195 -175.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.583 ' HB2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -139.7 117.35 11.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.138 0.494 . . . . 0.0 109.751 167.822 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -154.23 -176.57 5.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.086 -0.961 . . . . 0.0 108.691 175.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.52 -33.22 73.74 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 166.632 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.0 mt -75.51 14.43 0.61 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.799 178.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.441 ' HB2' ' HB3' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -61.57 -38.13 86.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.785 0.326 . . . . 0.0 110.194 -179.539 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.77 -26.52 59.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.113 178.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -64.94 -40.83 95.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.726 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -98.32 -13.35 20.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.651 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 55.56 48.88 17.76 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.477 0.656 . . . . 0.0 110.076 -174.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 27.3 m -149.3 76.85 1.34 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.945 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.524 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -120.74 150.96 40.16 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.931 176.617 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 3.5 m -70.81 144.25 50.87 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -29.55 69.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.895 0.378 . . . . 0.0 111.296 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -91.0 31.29 1.1 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.194 0.521 . . . . 0.0 110.957 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -65.52 -40.58 93.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.647 0.737 . . . . 0.0 109.652 179.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.404 ' HA ' ' HD2' ' A' ' 41' ' ' PRO . 0.1 OUTLIER -72.05 -34.08 68.49 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.726 179.73 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -71.12 -55.06 8.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.198 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.507 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 32.7 mt-10 -97.51 0.43 47.51 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -169.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -126.6 -36.74 2.22 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.444 173.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.24 74.87 0.51 Allowed Pre-proline 0 N--CA 1.465 0.29 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 171.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 36' ' ' THR . 17.8 Cg_endo -61.06 -62.88 0.12 Allowed 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.275 1.984 . . . . 0.0 111.831 177.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -172.73 139.84 0.94 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.939 177.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.5 t -127.62 120.38 54.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 174.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -119.52 -161.32 0.85 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.296 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.94 -39.73 10.05 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 178.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 133.81 85.42 0.25 Allowed Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.079 178.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.1 t0 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.925 -0.559 . . . . 0.0 109.535 179.668 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 5.2 t0 . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -97.13 100.44 11.92 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.502 ' H ' ' HB3' ' A' ' 19' ' ' CYS . 0.6 OUTLIER -82.72 -172.52 4.13 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.77 -178.931 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -97.09 136.91 36.96 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.927 179.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.484 ' H ' ' HB2' ' A' ' 34' ' ' ASP . 0.9 OUTLIER -84.39 154.13 23.02 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.629 -178.315 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.535 ' HG3' ' N ' ' A' ' 7' ' ' GLY . 0.0 OUTLIER -164.01 -33.77 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.91 177.388 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.535 ' N ' ' HG3' ' A' ' 6' ' ' LYS . . . -154.47 63.35 0.35 Allowed Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.211 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.41 -37.34 1.63 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 175.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.4 -21.2 65.6 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.748 -178.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -85.69 -13.03 49.74 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.355 -176.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -111.16 -54.7 2.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.657 -177.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.99 -171.14 26.25 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.695 -0.765 . . . . 0.0 111.853 -179.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.702 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 3.2 t80 -83.61 112.48 20.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.921 0.391 . . . . 0.0 111.137 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.457 ' C ' ' H ' ' A' ' 16' ' ' ASP . 1.5 t30 -99.57 103.0 14.68 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 171.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -78.53 42.67 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.512 0.673 . . . . 0.0 109.962 -177.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.457 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -128.8 -27.66 2.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.405 -178.555 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.506 ' HB2' ' OE1' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -87.15 -165.58 1.34 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.786 -177.37 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.46 -61.88 1.47 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.186 -178.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.502 ' HB3' ' H ' ' A' ' 3' ' ' GLU . 1.0 OUTLIER -110.22 138.88 46.0 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.273 0.558 . . . . 0.0 109.86 176.821 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.638 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 4.2 mp0 -120.32 152.42 37.85 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.622 -177.05 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.483 ' HB3' ' CD2' ' A' ' 35' ' ' TYR . 86.2 m -123.12 113.44 18.98 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 168.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.487 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 13.1 t70 -156.66 179.04 9.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.995 178.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.46 -35.53 75.72 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 165.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.1 mt -77.11 9.38 3.07 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.654 -179.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.702 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -60.86 -41.74 96.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.169 -175.963 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.66 -29.89 63.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.247 -177.003 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -62.85 -48.92 76.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.782 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -84.0 -15.16 48.69 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.226 177.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.82 45.35 15.57 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.611 -178.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -138.17 63.03 1.55 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.465 -178.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.638 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -102.77 153.28 20.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.875 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 3' ' ' GLU . 1.9 m -82.16 139.08 34.54 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 171.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -21.91 65.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.278 0.561 . . . . 0.0 111.474 -177.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.484 ' HB2' ' H ' ' A' ' 5' ' ' CYS . 0.7 OUTLIER -86.04 17.85 3.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.237 -175.345 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.483 ' CD2' ' HB3' ' A' ' 21' ' ' CYS . 15.0 t80 -64.53 -55.57 19.7 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.369 0.605 . . . . 0.0 110.409 -178.309 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.2 p -70.62 -29.03 65.3 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.254 -175.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -68.47 -55.08 13.01 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.892 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -91.36 -50.98 5.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.3 m -71.53 -47.27 56.27 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 121.225 -0.19 . . . . 0.0 111.055 -173.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 mtpp 59.36 77.5 0.39 Allowed Pre-proline 0 N--CA 1.464 0.231 0 O-C-N 123.409 0.443 . . . . 0.0 110.569 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -56.66 -64.05 0.15 Allowed 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 123.313 2.675 . . . . 0.0 112.573 -175.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -155.91 121.36 4.87 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.633 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.1 t -95.1 85.08 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 174.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -64.63 105.58 1.0 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.521 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -79.65 104.79 10.48 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 176.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.49 46.83 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 -177.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.482 -0.77 . . . . 0.0 110.48 -177.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.281 0 CA-C-O 120.487 0.184 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -153.88 161.03 42.35 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 177.106 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.61 34.39 23.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.572 0.701 . . . . 0.0 110.27 -175.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.536 ' HA ' ' HB2' ' A' ' 34' ' ' ASP . 0.8 OUTLIER -64.55 133.83 53.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.857 -178.574 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.452 ' HB3' ' HG3' ' A' ' 8' ' ' ARG . 2.8 m -77.97 119.7 21.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.904 177.356 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 mtmt -119.76 -54.77 2.13 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 176.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.88 -17.85 42.62 Favored Glycine 0 N--CA 1.44 -1.079 0 CA-C-N 115.276 -0.875 . . . . 0.0 112.349 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.452 ' HG3' ' HB3' ' A' ' 5' ' ' CYS . 0.1 OUTLIER -98.62 40.85 1.17 Allowed 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 122.025 -0.691 . . . . 0.0 110.501 -173.456 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.626 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.8 OUTLIER -131.44 -7.29 3.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.455 177.007 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.39 2.47 8.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.72 -174.573 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -104.68 12.21 33.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.225 0.536 . . . . 0.0 110.389 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 86.75 -173.29 45.2 Favored Glycine 0 N--CA 1.442 -0.953 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.61 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 7.9 t80 -93.73 107.13 19.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.691 0.282 . . . . 0.0 110.439 -178.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.421 ' C ' ' H ' ' A' ' 16' ' ' ASP . 0.8 OUTLIER -84.36 95.25 8.68 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.851 173.678 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -80.78 41.32 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.522 0.677 . . . . 0.0 110.115 -178.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.421 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -134.31 -13.26 2.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.051 -178.335 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.436 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 13.9 mmtm -91.85 179.3 5.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.143 0.497 . . . . 0.0 111.904 -170.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.92 -29.88 28.86 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.622 -178.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -140.01 149.45 43.23 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.61 ' HG2' ' CE1' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -130.73 146.09 52.11 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.999 -174.265 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.626 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 4.1 m -143.88 117.79 9.38 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 169.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.574 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 17.6 t70 -154.64 -179.35 7.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -69.12 -29.48 67.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 166.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 50.5 mt -79.56 14.42 1.65 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.167 176.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.574 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -63.28 -39.32 94.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.706 -0.225 . . . . 0.0 110.548 -179.867 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.95 -28.27 61.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.131 -179.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -64.15 -52.32 59.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.664 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -85.18 -16.17 41.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.927 -179.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.0 44.64 22.52 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.98 -179.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.6 m -141.77 56.74 1.5 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.192 -177.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.538 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.1 OUTLIER -108.76 146.03 34.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.663 179.131 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 m -69.55 156.88 38.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.891 179.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -28.57 69.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.968 0.413 . . . . 0.0 111.989 -177.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.536 ' HB2' ' HA ' ' A' ' 4' ' ' SER . 2.5 m-20 -85.25 13.97 5.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.293 -175.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.469 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 46.3 t80 -66.72 -50.5 62.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.094 0.473 . . . . 0.0 110.637 -177.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.479 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -70.63 -28.61 64.95 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.104 -178.224 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.52 -52.75 50.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.969 178.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -89.63 -53.74 4.39 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -71.01 -44.37 66.01 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.696 -172.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 36' ' ' THR . 0.2 OUTLIER 58.07 85.1 0.19 Allowed Pre-proline 0 N--CA 1.465 0.323 0 O-C-N 123.712 0.632 . . . . 0.0 112.088 176.861 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -75.98 -16.79 17.91 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.474 2.116 . . . . 0.0 111.501 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 61.81 86.69 0.11 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 115.234 -0.894 . . . . 0.0 111.153 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -86.76 153.05 3.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.001 -178.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.6 m -121.97 -6.54 8.98 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.91 -177.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 68.12 11.73 8.48 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.335 178.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.35 -125.45 7.15 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.141 -178.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.6 t70 . . . . . 0 C--O 1.244 0.802 0 CA-C-O 118.463 -0.78 . . . . 0.0 109.952 -179.33 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.58 132.53 42.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.853 0.359 . . . . 0.0 110.474 177.734 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.16 87.87 4.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.893 -177.376 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 74.0 m -77.98 146.7 35.28 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.258 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.621 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 44.4 t -83.05 149.87 26.67 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.358 -178.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -162.48 -64.26 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 123.555 0.535 . . . . 0.0 110.179 173.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.81 34.16 4.8 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.422 -173.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.464 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 2.2 mmp_? -98.97 -32.95 11.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.419 0.61 . . . . 0.0 110.149 175.032 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.472 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 1.0 OUTLIER -68.55 -21.69 64.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.416 -175.021 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.58 -27.52 45.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.265 -177.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.95 -50.31 4.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.891 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 135.77 -156.97 23.09 Favored Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 111.296 -0.722 . . . . 0.0 111.296 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.572 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 3.9 t80 -84.29 107.83 16.8 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.132 0.491 . . . . 0.0 110.915 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.446 ' C ' ' H ' ' A' ' 16' ' ' ASP . 0.2 OUTLIER -89.63 93.04 9.32 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.589 173.507 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -78.47 35.97 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.131 0.491 . . . . 0.0 110.885 -176.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.446 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.2 OUTLIER -133.37 2.3 3.53 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.114 177.569 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.407 ' HZ3' ' CG ' ' A' ' 16' ' ' ASP . 5.5 mmpp? -109.08 -169.52 1.5 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.311 -178.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.17 -63.79 1.11 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.452 -178.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.08 138.57 35.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.941 177.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.572 ' HG2' ' CE1' ' A' ' 13' ' ' PHE . 2.3 mp0 -129.08 145.61 51.23 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.271 -174.225 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.2 m -135.57 116.36 14.03 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 168.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -155.04 179.16 9.41 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.449 -0.796 . . . . 0.0 108.994 174.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.58 -22.07 63.56 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 167.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.6 mt -81.24 10.9 4.78 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.367 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -38.13 86.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.739 0.305 . . . . 0.0 110.567 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -26.8 65.65 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.403 179.59 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -77.81 -52.37 9.0 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.377 -176.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -88.25 -16.69 32.52 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.347 -177.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 72.8 mm-40 53.89 54.45 9.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.308 0.575 . . . . 0.0 111.028 -177.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.34 39.51 3.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.766 -178.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.526 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -98.53 147.58 24.62 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.226 -177.25 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.621 ' SG ' ' HB2' ' A' ' 5' ' ' CYS . 1.9 m -77.98 164.13 25.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.164 178.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.62 -38.11 86.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.931 -177.102 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.43 32.88 1.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.21 0.529 . . . . 0.0 110.929 -178.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.472 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 16.8 t80 -72.17 -41.75 66.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.5 0.667 . . . . 0.0 109.676 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -30.09 70.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.236 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.21 -54.63 11.99 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.258 177.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.6 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 46.3 mm-40 -68.73 -53.13 23.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.829 -175.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.509 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 0.5 OUTLIER -73.15 -48.79 32.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.524 -177.805 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.68 61.33 12.6 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.935 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.509 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 64.8 Cg_endo -81.14 -42.48 0.12 Allowed 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 121.902 1.735 . . . . 0.0 111.526 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -164.13 138.18 5.53 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.335 -0.848 . . . . 0.0 108.713 -178.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 61.7 t -80.69 113.61 20.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.588 ' O ' ' HD3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -75.9 38.98 0.17 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.145 -0.48 . . . . 0.0 112.264 -176.446 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.588 ' HD3' ' O ' ' A' ' 44' ' ' THR . 0.0 OUTLIER -158.79 155.53 28.09 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -178.435 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -130.63 -152.3 7.35 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.086 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.0 t70 . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.349 -0.834 . . . . 0.0 109.804 -179.972 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.1 t0 . . . . . 0 N--CA 1.48 1.039 0 CA-C-O 121.287 0.565 . . . . 0.0 110.578 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.425 ' NE2' ' HG ' ' A' ' 4' ' ' SER . 0.0 OUTLIER -128.76 151.4 49.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.963 179.767 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -78.77 71.08 5.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.381 0.61 . . . . 0.0 110.128 178.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.425 ' HG ' ' NE2' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -150.62 161.54 42.39 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.018 178.594 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.471 ' HB3' ' HG2' ' A' ' 38' ' ' GLU . 30.0 m -112.13 122.07 46.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 176.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.455 ' HE2' ' O ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -146.58 28.91 1.05 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.063 0.459 . . . . 0.0 110.567 -178.501 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 141.97 26.28 0.18 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.799 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.416 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.2 OUTLIER -82.37 -27.38 32.15 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.469 ' HB2' ' OE1' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -70.1 -18.49 63.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.27 0.557 . . . . 0.0 110.208 -179.921 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -107.48 -11.38 15.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.355 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.92 -16.94 14.71 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.067 0.461 . . . . 0.0 110.683 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 112.67 146.05 9.75 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.812 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.557 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 10.0 t80 -56.22 107.36 0.36 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.454 0.645 . . . . 0.0 110.655 178.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.469 HD22 ' HA ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -83.66 81.92 8.54 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.45 179.307 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -1.18 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.053 0.454 . . . . 0.0 110.412 -178.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.56 -9.28 25.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.193 179.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.416 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -96.63 -176.63 3.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.795 0.331 . . . . 0.0 111.344 -176.084 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -82.03 -56.09 4.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.649 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.43 138.23 48.19 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.616 -0.512 . . . . 0.0 109.616 176.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.642 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -127.82 149.63 50.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.278 -171.942 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.416 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 53.8 m -144.92 119.37 9.65 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.343 174.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.475 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 6.8 t0 -153.1 -174.8 5.07 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 169.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -68.29 -21.89 64.76 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 170.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -86.41 14.47 6.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.99 177.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.557 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -59.41 -40.96 88.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.611 178.979 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -26.03 60.64 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.004 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -66.21 -45.64 80.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.63 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -90.91 -17.0 27.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.769 0.319 . . . . 0.0 110.745 178.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 52.81 50.36 18.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.573 -174.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -142.04 48.24 1.6 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.079 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.642 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.64 146.77 24.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.799 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.23 160.77 27.74 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.397 177.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -29.5 70.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.938 -178.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -85.82 28.25 0.8 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.749 0.309 . . . . 0.0 111.234 -179.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -70.51 -47.58 59.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.459 0.647 . . . . 0.0 110.082 -178.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -28.88 66.42 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.997 -178.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.98 -48.96 74.35 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.747 178.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.471 ' HG2' ' HB3' ' A' ' 5' ' ' CYS . 0.3 OUTLIER -87.58 -40.39 14.27 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.484 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.437 ' N ' ' HG3' ' A' ' 38' ' ' GLU . 49.1 t -91.81 -55.57 3.42 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.333 -175.041 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 tttt 47.85 67.41 4.51 Favored Pre-proline 0 N--CA 1.465 0.299 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.119 -173.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.97 -47.45 17.93 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.579 2.186 . . . . 0.0 111.515 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.4 -69.6 0.07 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.182 176.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.694 HG13 ' HB2' ' A' ' 45' ' ' ARG . 14.2 p -162.5 151.72 3.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.559 178.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.68 52.1 0.8 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.076 0.465 . . . . 0.0 111.708 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.694 ' HB2' HG13 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -101.36 48.05 0.9 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.067 0.461 . . . . 0.0 111.05 -177.504 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -112.45 -7.93 21.88 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.762 -0.732 . . . . 0.0 111.799 178.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.7 t70 . . . . . 0 C--O 1.245 0.816 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -178.323 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 38.8 t0 . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.76 37.0 22.27 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.39 0.614 . . . . 0.0 110.323 -175.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -94.56 7.52 45.37 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.745 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.31 147.68 7.58 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.836 178.052 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 3.5 t -82.93 118.6 23.58 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.418 -176.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.427 ' HE2' ' O ' ' A' ' 5' ' ' CYS . 13.5 mmtt -141.63 -60.98 0.47 Allowed 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 175.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -128.32 51.68 0.85 Allowed Glycine 0 N--CA 1.444 -0.794 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.851 176.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.525 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -91.71 -21.1 20.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.113 0.482 . . . . 0.0 109.761 177.004 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -76.54 -18.12 58.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.76 -176.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.76 -21.16 41.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.765 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.6 -42.22 6.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.18 -179.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 122.1 179.54 15.97 Favored Glycine 0 N--CA 1.444 -0.768 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 -177.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.718 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 6.6 t80 -62.36 107.11 0.85 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.185 0.517 . . . . 0.0 110.635 177.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.42 ' ND2' ' HB2' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -89.3 84.59 6.48 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.852 176.161 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.45 -14.48 18.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.2 0.524 . . . . 0.0 109.902 -177.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -21.44 54.81 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.224 177.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.42 ' HB2' ' ND2' ' A' ' 14' ' ' ASN . 1.7 mmpp? -84.02 171.2 13.16 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.14 -9.87 37.9 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.117 0.484 . . . . 0.0 110.36 -179.011 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.425 ' HB3' ' O ' ' A' ' 3' ' ' GLU . 1.8 t -137.2 138.2 39.93 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 172.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.567 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 26.7 mp0 -131.8 148.03 52.53 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.844 0.354 . . . . 0.0 111.86 -169.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 64.8 m -142.34 118.26 10.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.725 170.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -153.3 -173.7 4.67 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 167.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -19.46 63.74 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 169.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 mt -88.44 14.62 9.3 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.252 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.718 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -60.73 -37.38 81.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.68 0.276 . . . . 0.0 110.776 -178.578 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -26.7 60.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.245 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -68.46 -44.07 75.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.582 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -88.43 -15.75 34.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.406 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.414 ' C ' ' HG ' ' A' ' 30' ' ' SER . 2.6 mm-40 56.8 49.5 14.14 Favored 'General case' 0 CA--C 1.522 -0.1 0 O-C-N 123.713 0.633 . . . . 0.0 110.152 -176.347 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.414 ' HG ' ' C ' ' A' ' 29' ' ' GLN . 12.2 m -151.39 76.47 1.22 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.224 -179.084 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.567 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -118.67 151.5 37.84 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.994 176.179 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 3.3 m -80.11 160.12 25.85 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.91 0.386 . . . . 0.0 110.967 177.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -26.92 68.89 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.142 0.496 . . . . 0.0 111.317 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.61 7.34 36.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.486 -177.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.471 ' CD1' ' HB3' ' A' ' 21' ' ' CYS . 13.5 t80 -62.59 -47.18 84.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.323 0.582 . . . . 0.0 110.123 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -32.97 63.94 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.057 -178.316 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.89 -50.45 34.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.036 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -93.1 -35.63 13.1 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -172.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 69.6 m -97.03 -55.17 2.95 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.428 -177.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 64.95 102.85 0.03 OUTLIER Pre-proline 0 C--O 1.232 0.153 0 O-C-N 123.612 0.57 . . . . 0.0 110.868 179.237 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -51.99 -46.69 30.77 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 123.071 2.514 . . . . 0.0 111.998 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 60.23 28.67 18.28 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.358 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 p -116.12 128.0 73.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 177.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.51 120.05 27.43 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.897 0.38 . . . . 0.0 111.312 -176.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -82.86 97.75 8.81 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -81.02 47.43 3.56 Favored Glycine 0 N--CA 1.454 -0.134 0 C-N-CA 121.179 -0.534 . . . . 0.0 113.169 -174.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.294 -0.86 . . . . 0.0 109.547 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . 0.521 ' HB2' ' H ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 110.458 -0.201 . . . . 0.0 110.458 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.521 ' H ' ' HB2' ' A' ' 1' ' ' ASP . 0.8 OUTLIER -86.42 136.25 33.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.089 0.471 . . . . 0.0 111.246 -174.582 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.4 2.0 10.74 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.291 175.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -98.48 141.81 30.88 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.944 -170.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.417 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 6.1 t -92.49 142.55 27.29 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.687 175.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.426 ' HB2' ' HE2' ' A' ' 6' ' ' LYS . 12.6 mtmm -118.82 -78.02 0.58 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.901 0.382 . . . . 0.0 110.328 178.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -143.19 31.63 1.94 Allowed Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.512 -0.851 . . . . 0.0 111.884 -176.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -82.33 8.95 9.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.867 0.365 . . . . 0.0 111.188 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.459 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 25.9 m -74.66 -16.69 60.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.44 0.638 . . . . 0.0 109.563 176.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -110.1 10.8 23.96 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.286 -177.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -110.45 11.92 23.07 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.697 0.761 . . . . 0.0 109.439 175.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.93 161.4 32.22 Favored Glycine 0 N--CA 1.445 -0.764 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.2 -177.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -73.56 107.2 5.69 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.287 175.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.437 HD22 ' HA ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -83.81 112.18 19.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.023 178.363 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -90.57 3.51 6.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.023 0.44 . . . . 0.0 110.555 -177.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -138.73 53.45 1.77 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.233 0.54 . . . . 0.0 110.88 177.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.437 ' CG ' ' HB2' ' A' ' 14' ' ' ASN . 6.8 mmmm -129.51 -171.3 2.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.8 172.4 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.2 -58.42 4.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.27 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -132.05 153.41 50.45 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.515 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -126.7 141.7 51.76 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -171.899 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.459 ' HB3' ' SG ' ' A' ' 9' ' ' CYS . 92.7 m -139.15 119.3 13.56 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.875 0.369 . . . . 0.0 110.986 174.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.426 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 19.2 t70 -153.93 -172.96 4.39 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 168.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.37 -23.8 63.79 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 167.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.1 mt -80.5 8.92 6.72 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.346 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -61.13 -39.1 88.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.879 0.371 . . . . 0.0 110.066 179.367 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.85 -26.66 62.45 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.104 178.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -66.85 -42.09 86.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.68 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -96.1 -17.5 20.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.03 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 55.47 47.06 21.87 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.101 0.477 . . . . 0.0 110.941 -175.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.502 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 0.3 OUTLIER -141.94 46.73 1.65 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.183 -178.197 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -95.29 153.71 17.54 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.593 179.815 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.42 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -66.62 156.41 35.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.582 179.08 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -37.71 75.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -172.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -103.39 31.74 4.18 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.982 0.42 . . . . 0.0 110.979 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.583 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 7.9 t80 -62.59 -42.88 99.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.492 0.663 . . . . 0.0 109.265 178.032 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.537 ' O ' ' HD3' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -73.35 -32.4 64.51 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.85 179.724 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.61 -57.62 6.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.527 -178.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -87.17 -41.9 13.4 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.583 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 52.0 t -78.94 -46.8 17.61 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.401 -175.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.537 ' HD3' ' O ' ' A' ' 36' ' ' THR . 0.3 OUTLIER 55.3 75.4 0.6 Allowed Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.891 177.206 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo -48.01 -49.74 13.29 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.451 2.767 . . . . 0.0 112.545 -178.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.499 ' HA ' ' OE1' ' A' ' 42' ' ' GLN . 1.9 tp-100 49.32 51.68 15.86 Favored 'General case' 0 N--CA 1.462 0.145 0 O-C-N 123.598 0.561 . . . . 0.0 111.783 178.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.484 HG11 ' HB2' ' A' ' 45' ' ' ARG . 19.1 t -95.19 112.81 28.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.033 178.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -77.68 60.23 2.15 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.057 0.456 . . . . 0.0 111.043 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.522 ' HB3' ' H ' ' A' ' 46' ' ' GLY . 0.1 OUTLIER -123.58 -98.92 0.42 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.631 -178.213 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.522 ' H ' ' HB3' ' A' ' 45' ' ' ARG . . . 67.12 -139.3 35.82 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.979 -178.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.3 t70 . . . . . 0 C--O 1.249 1.059 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.136 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . 0.483 ' OD2' ' HB2' ' A' ' 18' ' ' LYS . 1.7 t70 . . . . . 0 N--CA 1.48 1.046 0 CA-C-O 120.551 0.215 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -76.67 -3.98 40.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.928 0.395 . . . . 0.0 111.789 -175.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -94.42 -158.54 0.64 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.97 0.414 . . . . 0.0 110.51 179.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.02 170.3 13.12 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.723 0.773 . . . . 0.0 112.268 -177.543 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 38.5 t -91.28 125.17 35.96 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.189 177.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.78 4.98 43.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.266 0.555 . . . . 0.0 110.021 177.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.594 ' HA2' ' SG ' ' A' ' 39' ' ' CYS . . . 114.71 55.84 0.38 Allowed Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.561 -174.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.664 ' HG3' ' SG ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -84.08 7.14 19.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.469 0.652 . . . . 0.0 109.953 -178.908 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.481 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 16.4 m -72.34 -3.79 25.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.348 176.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 15.7 p -79.77 -24.61 41.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.474 0.654 . . . . 0.0 109.715 172.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -95.57 -22.8 17.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.493 -177.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.72 177.0 45.46 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 -176.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.692 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 4.0 t80 -72.87 108.39 5.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.145 0.497 . . . . 0.0 110.741 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.553 ' HB3' ' HB2' ' A' ' 17' ' ' LYS . 7.6 t-20 -96.74 106.97 19.35 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 172.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -75.49 -3.77 5.26 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.228 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -94.11 -6.86 44.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.752 176.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.553 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -94.69 159.95 14.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.843 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.583 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -84.53 -34.24 23.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.774 0.321 . . . . 0.0 110.567 -174.85 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -120.0 138.44 53.49 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 171.218 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.576 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 22.1 mp0 -127.01 140.89 51.97 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.735 -173.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.664 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -135.1 115.59 13.61 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.171 167.429 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.59 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 24.8 t70 -155.78 179.35 9.28 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.031 173.095 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -68.63 -26.76 65.51 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 168.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mt -76.95 5.89 7.18 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.466 177.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.692 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -61.34 -38.44 86.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.828 0.346 . . . . 0.0 110.547 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.99 -27.51 64.76 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.914 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -70.7 -46.87 62.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.903 -178.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -88.21 -12.79 42.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.658 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 55.17 47.67 21.21 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 121.639 0.733 . . . . 0.0 109.643 -174.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.447 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 16.5 m -145.12 77.76 1.53 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.189 -177.192 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -126.8 151.18 48.63 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.333 175.378 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.6 m -73.85 141.43 46.13 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 172.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -31.59 64.08 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -174.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.42 21.93 1.36 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.444 -177.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.481 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 19.2 t80 -67.99 -49.37 62.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.301 0.572 . . . . 0.0 110.324 -177.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.6 -29.98 62.72 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.648 -176.427 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.87 -45.79 66.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.517 177.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -89.02 -53.91 4.37 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -174.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.594 ' SG ' ' HA2' ' A' ' 7' ' ' GLY . 1.4 m -76.2 -40.21 52.84 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.365 -175.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.76 92.05 0.07 OUTLIER Pre-proline 0 N--CA 1.464 0.237 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.386 175.258 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -81.1 -149.05 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.028 2.486 . . . . 0.0 111.365 175.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -132.25 15.58 4.59 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.106 -179.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 67.8 t 66.93 101.39 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 CA-C-N 116.114 -0.493 . . . . 0.0 109.819 -173.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.76 83.77 0.3 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.471 -175.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -119.78 116.56 26.16 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 173.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -76.64 -25.94 64.1 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.479 -179.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.079 0 CA-C-O 117.852 -1.07 . . . . 0.0 109.435 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.481 1.102 0 CA-C-O 119.909 -0.091 . . . . 0.0 110.831 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.37 83.07 0.14 Allowed 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.262 0.554 . . . . 0.0 110.04 -175.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.444 ' OE2' ' HB3' ' A' ' 32' ' ' CYS . 12.2 tp10 -69.71 97.23 1.04 Allowed 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.707 -172.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -168.38 107.38 0.5 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.649 175.184 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.785 ' SG ' ' HB2' ' A' ' 32' ' ' CYS . 84.0 m -97.55 162.83 13.11 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 168.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.48 -101.3 0.09 Allowed 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.851 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -96.13 4.79 65.33 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.217 -0.753 . . . . 0.0 111.217 -177.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 5.5 ptt-85 -79.61 66.77 5.18 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 122.063 0.935 . . . . 0.0 108.988 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.454 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -148.11 10.87 0.91 Allowed 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.744 166.685 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -145.9 9.93 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.59 177.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.87 -27.49 11.69 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.75 -175.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 119.2 145.49 7.65 Favored Glycine 0 N--CA 1.444 -0.832 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 -173.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.675 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 12.9 t80 -69.91 107.37 3.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 121.312 0.577 . . . . 0.0 110.716 -174.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.416 ' C ' ' H ' ' A' ' 16' ' ' ASP . 0.1 OUTLIER -84.55 97.62 9.68 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.421 174.41 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -87.32 28.83 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.216 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.416 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.2 OUTLIER -135.87 19.58 3.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.515 -175.368 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.89 -176.1 2.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.605 179.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.93 -60.39 2.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.4 t -100.26 138.88 36.73 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 172.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.563 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.1 mp0 -108.6 135.35 50.0 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.923 0.392 . . . . 0.0 110.279 -175.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.518 ' SG ' ' HD1' ' A' ' 35' ' ' TYR . 0.8 OUTLIER -156.3 122.23 4.94 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.946 175.127 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.454 ' HA ' ' HA ' ' A' ' 9' ' ' CYS . 3.4 t70 -155.83 -169.03 2.96 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 160.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -14.53 62.96 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.181 0.515 . . . . 0.0 110.154 174.092 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.78 12.38 30.22 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.227 179.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.675 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -54.57 -40.45 68.79 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.634 0.254 . . . . 0.0 111.309 178.861 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -37.38 78.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.917 0.389 . . . . 0.0 111.028 -179.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -62.54 -48.31 80.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.679 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -81.83 -15.7 53.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.108 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.408 ' C ' ' HG ' ' A' ' 30' ' ' SER . 0.8 OUTLIER 56.09 47.65 19.21 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.506 0.669 . . . . 0.0 110.334 -176.609 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.408 ' HG ' ' C ' ' A' ' 29' ' ' GLN . 9.0 m -150.68 77.21 1.28 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.971 -177.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.563 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -125.9 157.26 38.15 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.27 174.994 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.785 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 2.6 m -71.02 158.84 35.81 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 174.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.12 -29.69 69.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.965 -173.218 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -94.38 32.97 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.483 0.658 . . . . 0.0 111.047 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.518 ' HD1' ' SG ' ' A' ' 21' ' ' CYS . 45.6 t80 -62.18 -38.72 90.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.583 179.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.541 ' O ' ' HA ' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -69.96 -29.01 66.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.986 -179.814 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.72 -45.73 67.54 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.143 0.497 . . . . 0.0 111.006 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -82.11 -51.33 8.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.084 -175.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.6 t -75.65 -41.35 54.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.912 0.387 . . . . 0.0 110.206 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 63.19 66.59 1.16 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.277 -0.874 . . . . 0.0 113.038 175.875 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -81.94 -172.11 1.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.205 1.937 . . . . 0.0 110.617 170.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.86 136.81 12.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.006 0.431 . . . . 0.0 111.023 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 49.1 t -122.39 132.44 71.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 174.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.97 104.81 0.15 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.232 0.539 . . . . 0.0 111.806 -177.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -122.71 49.92 1.57 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.214 -178.621 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 172.51 38.48 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.243 -0.979 . . . . 0.0 112.538 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.2 t0 . . . . . 0 C--O 1.243 0.735 0 CA-C-O 118.655 -0.688 . . . . 0.0 109.563 177.8 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.719 0.295 . . . . 0.0 111.305 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -89.42 101.56 14.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.039 0.447 . . . . 0.0 111.751 -177.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.49 13.8 27.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.732 0.777 . . . . 0.0 109.879 173.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.14 153.13 34.51 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.074 179.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.453 ' SG ' ' HB2' ' A' ' 32' ' ' CYS . 0.0 OUTLIER -64.94 120.84 13.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.739 -178.975 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.66 -70.7 0.76 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 173.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.26 61.15 0.63 Allowed Glycine 0 N--CA 1.439 -1.113 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.364 177.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.8 ptp180 -130.62 8.27 4.92 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.837 0.351 . . . . 0.0 110.176 175.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.719 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 83.5 m -103.18 19.55 19.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.634 0.731 . . . . 0.0 109.486 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.84 -46.7 1.97 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.069 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.54 -54.18 46.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.84 174.08 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 149.88 175.39 22.04 Favored Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 121.058 -0.592 . . . . 0.0 111.765 -179.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.577 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 30.0 t80 -65.81 113.91 4.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.163 0.506 . . . . 0.0 111.185 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.596 HD22 ' HA ' ' A' ' 20' ' ' GLN . 0.7 OUTLIER -81.89 116.04 21.36 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.667 172.125 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -97.85 -11.34 8.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-O 121.439 0.637 . . . . 0.0 109.398 177.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -33.92 37.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.38 179.184 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.432 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 3.1 mmtm -70.69 -178.64 1.9 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.167 0.508 . . . . 0.0 111.96 -174.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.82 -47.25 7.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.725 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -109.55 139.49 44.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.491 174.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.692 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -123.2 142.16 51.2 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 120.826 0.346 . . . . 0.0 111.385 -174.089 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.719 ' HB3' ' SG ' ' A' ' 9' ' ' CYS . 1.3 m -145.82 115.9 7.42 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.048 172.385 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.613 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 21.3 t70 -156.39 -176.95 6.24 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.6 -33.92 75.97 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 166.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.63 5.24 3.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.884 178.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.613 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -64.33 -33.63 76.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 -179.631 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.09 -25.92 64.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.783 178.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -73.19 -34.18 65.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.942 -178.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -102.9 -16.39 15.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.673 0.273 . . . . 0.0 111.134 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 59.11 36.47 24.13 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.397 -178.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -133.07 51.84 2.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.404 -177.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.692 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -97.51 148.27 23.41 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.338 177.902 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.453 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 1.8 m -74.53 162.22 29.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.658 178.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.46 -25.19 67.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.929 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.37 12.06 9.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.66 -176.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.442 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 31.0 t80 -63.53 -50.28 70.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.558 0.694 . . . . 0.0 110.754 -176.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -29.52 62.17 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.326 -176.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.69 -54.51 18.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.089 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -84.06 -53.27 5.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 0.0 112.034 -174.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.8 m -77.7 -47.95 17.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.182 -171.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.94 73.09 0.89 Allowed Pre-proline 0 N--CA 1.465 0.316 0 O-C-N 123.541 0.525 . . . . 0.0 111.395 178.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.592 ' HB2' HG22 ' A' ' 43' ' ' VAL . 17.9 Cg_endo -60.18 -42.3 44.13 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.561 2.174 . . . . 0.0 112.223 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 56.16 36.65 27.79 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.04 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.592 HG22 ' HB2' ' A' ' 41' ' ' PRO . 35.5 t -91.58 95.14 5.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.702 -178.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.51 -51.62 16.43 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.272 0.558 . . . . 0.0 110.346 176.072 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -131.58 102.58 5.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.178 179.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -113.49 33.86 5.31 Favored Glycine 0 N--CA 1.454 -0.148 0 C-N-CA 121.086 -0.578 . . . . 0.0 111.751 179.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.737 0 CA-C-O 118.175 -0.917 . . . . 0.0 109.306 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 14.5 t0 . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 56.83 54.56 7.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.266 0.555 . . . . 0.0 110.534 -175.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 43.8 mp0 -78.91 -111.44 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.349 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.98 159.01 29.22 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.952 0.406 . . . . 0.0 111.2 -178.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.455 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 4.7 t -99.34 169.3 9.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.365 178.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.545 ' HG3' ' N ' ' A' ' 7' ' ' GLY . 0.5 OUTLIER 176.96 -36.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.844 175.149 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.545 ' N ' ' HG3' ' A' ' 6' ' ' LYS . . . -147.89 62.27 0.44 Allowed Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.832 -0.699 . . . . 0.0 111.955 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.61 ' HG3' ' SG ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -120.91 -40.14 2.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.99 0.424 . . . . 0.0 110.022 174.253 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.4 m -64.26 -19.66 65.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.256 0.551 . . . . 0.0 110.4 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -81.27 -15.08 56.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.64 -178.004 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.93 -4.75 9.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.738 -176.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.7 -175.16 51.98 Favored Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 111.321 -0.712 . . . . 0.0 111.321 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -69.4 109.74 4.34 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.224 0.535 . . . . 0.0 111.619 -177.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.426 ' C ' ' H ' ' A' ' 16' ' ' ASP . 1.3 t30 -92.21 102.07 14.58 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.088 169.257 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -78.32 47.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.962 0.886 . . . . 0.0 109.968 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -138.09 -35.42 0.63 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.771 -179.108 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.526 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -71.13 166.93 20.39 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.652 -174.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.3 -37.13 16.24 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.861 -175.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -103.98 137.63 41.68 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 172.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.531 ' HB2' ' O ' ' A' ' 30' ' ' SER . 24.2 mp0 -121.63 121.79 38.16 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.243 -173.5 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.61 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -139.57 115.45 10.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.993 0.425 . . . . 0.0 110.116 170.599 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -155.99 -175.17 5.29 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -68.75 -32.36 72.07 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 165.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.7 mt -78.68 7.39 6.96 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.816 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.17 -33.8 76.88 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -26.86 62.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.588 178.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.422 ' HD2' ' CE1' ' A' ' 28' ' ' TYR . 35.7 t80 -67.97 -43.8 78.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.607 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.422 ' CE1' ' HD2' ' A' ' 27' ' ' TYR . 93.8 m-85 -86.29 -16.06 38.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.848 0.356 . . . . 0.0 110.551 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 60.82 38.58 17.88 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.603 -178.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 5.7 m -145.5 72.85 1.33 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.316 -177.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.431 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -101.09 156.94 17.12 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.164 177.161 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 58.7 m -62.88 144.94 56.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.549 175.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.91 -26.98 67.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.184 178.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.05 26.57 7.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.76 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.478 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 11.6 t80 -65.93 -38.34 88.41 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.509 0.671 . . . . 0.0 109.633 -177.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.15 -33.77 63.63 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.184 178.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.61 -50.17 39.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.84 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -87.81 -45.97 9.85 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.149 -173.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.478 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 35.3 t -88.28 -37.08 16.32 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.915 -0.314 . . . . 0.0 111.06 -173.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt 62.46 84.6 0.19 Allowed Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 112.659 0.615 . . . . 0.0 112.659 172.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -86.89 27.21 0.58 Allowed 'Trans proline' 0 CA--C 1.534 0.525 0 C-N-CA 123.134 2.556 . . . . 0.0 112.385 175.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -18.13 105.29 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.435 1.494 . . . . 0.0 113.626 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -80.2 141.87 14.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.02 -177.502 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.53 159.39 30.4 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.469 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.74 150.86 20.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.848 -178.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 131.57 -32.98 2.84 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.434 178.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 t70 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.818 -0.611 . . . . 0.0 110.189 -178.876 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.517 0 CA-C-O 120.909 0.385 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.493 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 1.2 m -91.99 128.3 37.78 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-O 120.959 0.409 . . . . 0.0 111.356 -178.38 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.93 -99.02 0.34 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.884 175.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.68 6.84 74.23 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.948 -177.402 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.533 ' HA ' ' OE1' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -85.94 45.54 1.23 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.147 0.498 . . . . 0.0 110.078 -176.423 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.3 t -133.76 17.06 3.91 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.603 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.73 -38.01 2.42 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.588 -176.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.533 ' OE1' ' HA ' ' A' ' 8' ' ' ARG . 2.4 pm0 -72.92 -26.58 61.45 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.818 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 126.59 175.07 14.01 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.654 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.41 ' HD2' ' HB3' ' A' ' 22' ' ' ASP . 18.5 t80 -68.5 116.04 8.6 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.9 0.381 . . . . 0.0 111.334 -176.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -79.47 97.84 6.57 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 170.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -80.07 -2.86 5.77 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-O 121.304 0.573 . . . . 0.0 109.644 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -119.79 46.79 1.86 Allowed 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.384 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.58 172.11 12.29 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 171.293 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.13 -21.79 42.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.225 0.536 . . . . 0.0 110.171 178.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 t -149.18 138.48 21.54 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.027 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.575 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -130.68 151.98 50.53 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -168.151 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.5 m -142.46 120.13 11.83 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.573 172.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.538 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 28.7 t0 -154.31 -179.54 8.03 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 170.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.62 -22.54 65.33 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 167.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.6 mt -85.53 14.21 5.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.119 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.538 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -61.23 -39.3 89.8 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 178.707 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.29 -25.96 59.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.799 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -67.5 -47.83 68.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.731 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -90.04 -16.06 30.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.641 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 58.86 50.53 8.43 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.423 0.63 . . . . 0.0 110.085 -173.034 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -147.92 78.22 1.44 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.506 -177.358 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.575 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.1 OUTLIER -127.73 147.42 50.4 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.325 175.162 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 5' ' ' CYS . 4.1 m -73.84 169.42 17.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.156 0.503 . . . . 0.0 111.741 178.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.65 -28.27 64.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.471 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.493 ' OD1' ' HB2' ' A' ' 5' ' ' CYS . 0.4 OUTLIER -89.56 17.05 6.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.763 0.316 . . . . 0.0 110.772 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -67.11 -48.03 69.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.564 0.697 . . . . 0.0 109.579 178.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -29.72 64.22 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.752 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.99 -57.79 4.59 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.388 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 24.5 mm-40 -78.96 -42.6 26.41 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -173.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.1 t -84.12 -55.4 4.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.363 -174.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 mttt 61.52 76.16 0.41 Allowed Pre-proline 0 N--CA 1.467 0.408 0 CA-C-O 121.103 0.478 . . . . 0.0 110.429 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo . . . . . 0 C--N 1.344 0.327 0 C-N-CA 122.67 2.246 . . . . 0.0 113.402 -174.58 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.388 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.638 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -86.27 121.69 29.2 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.804 -178.065 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -151.51 -88.32 0.06 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.461 -0.791 . . . . 0.0 108.999 176.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.46 34.43 2.9 Favored Glycine 0 N--CA 1.451 -0.366 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.136 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.495 ' HD2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -128.13 10.54 6.38 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.831 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.634 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 4.0 t -115.0 -11.29 12.15 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 173.34 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.88 -6.06 20.53 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.191 -177.519 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.489 ' HG2' ' HA ' ' A' ' 8' ' ' ARG . 22.0 pt-20 -105.05 -14.56 15.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.988 -177.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.21 149.94 25.86 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.915 -176.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.445 ' CE2' ' HG2' ' A' ' 20' ' ' GLN . 2.6 t80 -56.94 109.12 0.59 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.11 0.481 . . . . 0.0 111.869 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.461 ' C ' ' H ' ' A' ' 16' ' ' ASP . 54.7 t30 -99.98 113.46 26.05 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 170.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.2 t -78.83 39.08 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.818 0.818 . . . . 0.0 110.509 -177.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.461 ' H ' ' C ' ' A' ' 14' ' ' ASN . 24.5 t0 -151.35 29.19 0.63 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.036 173.013 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.617 ' HB2' HE22 ' A' ' 20' ' ' GLN . 7.0 mmtp -110.09 155.06 22.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.468 175.513 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -74.09 0.11 Allowed 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.324 0.39 . . . . 0.0 111.032 178.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -102.4 154.97 18.57 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 174.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.617 HE22 ' HB2' ' A' ' 17' ' ' LYS . 1.1 tp-100 -138.62 146.71 42.05 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -171.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.634 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 39.8 m -140.56 117.69 11.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.21 -0.904 . . . . 0.0 108.866 168.019 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.534 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 10.7 t70 -154.76 179.4 9.12 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -69.38 -35.11 75.48 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 165.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 40.7 mt -74.93 2.29 10.73 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.393 178.16 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.534 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -63.72 -33.74 76.32 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 178.218 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -36.12 63.09 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.128 0.489 . . . . 0.0 110.488 176.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -62.76 -46.45 87.98 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.431 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -89.44 -8.74 52.37 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.338 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 52.91 47.22 25.15 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.201 0.524 . . . . 0.0 111.473 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.4 m -148.06 73.41 1.26 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.604 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -120.15 152.08 38.16 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.852 0.358 . . . . 0.0 110.883 177.216 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.489 ' SG ' ' SG ' ' A' ' 5' ' ' CYS . 1.6 m -76.34 159.06 30.88 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.101 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -25.87 67.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.012 0.434 . . . . 0.0 111.515 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.2 15.62 4.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.798 -177.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.447 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 23.3 t80 -65.79 -50.8 63.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.425 0.631 . . . . 0.0 110.162 -177.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.13 -29.5 62.94 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.048 -176.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.86 -49.91 59.47 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.212 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.638 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 31.1 mm-40 -84.35 -51.38 7.01 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.26 -0.427 . . . . 0.0 112.15 -174.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.09 -42.55 23.41 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.852 -175.439 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.18 56.32 14.1 Favored Pre-proline 0 N--CA 1.469 0.475 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 177.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo . . . . . 0 C--N 1.347 0.488 0 C-N-CA 122.22 1.946 . . . . 0.0 112.726 -178.31 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m . . . . . 0 N--CA 1.445 -0.68 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.598 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -71.09 149.52 46.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.635 -175.387 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -144.48 -104.42 0.11 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.138 173.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -89.72 37.5 3.34 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.961 -0.638 . . . . 0.0 113.438 -173.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.554 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -74.18 -26.39 60.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.003 0.43 . . . . 0.0 110.025 177.54 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.412 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 0.8 OUTLIER -72.71 -23.85 60.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.754 -174.676 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.64 -36.13 16.43 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.906 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -71.36 -43.33 67.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.274 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 119.65 175.03 15.76 Favored Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 111.364 -0.694 . . . . 0.0 111.364 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.425 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 4.2 t80 -76.02 107.63 8.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.166 0.508 . . . . 0.0 110.515 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -93.23 100.79 13.09 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.737 174.215 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.3 t -77.44 52.23 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.853 0.835 . . . . 0.0 110.457 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -151.67 -30.66 0.16 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.188 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.532 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -77.02 163.43 26.69 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.17 176.278 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -77.61 -62.9 1.51 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.245 -171.141 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.74 138.61 34.04 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.058 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.579 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.7 tp60 -130.86 142.91 50.41 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.703 -173.086 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.554 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 92.6 m -135.72 118.01 15.62 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 170.21 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.468 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 14.9 t70 -153.77 178.54 9.77 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 177.458 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.81 -25.87 63.98 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 166.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.446 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 0.3 OUTLIER -80.74 14.32 2.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.511 176.205 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.468 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -63.46 -47.52 81.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.551 -178.739 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.72 -25.61 66.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.224 0.535 . . . . 0.0 110.928 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.446 ' HB3' ' O ' ' A' ' 24' ' ' LEU . 78.0 t80 -63.29 -39.03 93.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.784 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -105.01 -16.44 14.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.414 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 58.1 38.78 26.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.284 0.564 . . . . 0.0 110.717 -177.372 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.4 m -127.57 41.47 3.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.761 -177.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.88 150.1 21.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.624 -179.538 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.0 m -73.24 154.11 40.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.333 177.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.87 -37.45 79.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.92 0.391 . . . . 0.0 111.773 -178.674 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.14 40.22 1.04 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.593 0.711 . . . . 0.0 110.889 -179.21 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.422 ' HD1' ' SG ' ' A' ' 21' ' ' CYS . 19.8 t80 -70.87 -42.78 69.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.688 178.648 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -31.8 72.97 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.354 -178.351 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.88 -43.56 79.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.804 -178.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.598 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 63.7 mm-40 -95.0 -37.59 11.06 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -173.55 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.9 t -82.38 -48.86 10.65 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.367 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 47.93 62.86 11.26 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.102 -177.501 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo . . . . . 0 C--N 1.345 0.377 0 C-N-CA 122.694 2.263 . . . . 0.0 113.299 -171.833 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 120.886 0.374 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.523 ' HA ' ' HG3' ' A' ' 8' ' ' ARG . 30.3 m -100.29 131.85 45.99 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.439 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.13 -68.63 0.87 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.13 0.49 . . . . 0.0 109.839 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -115.32 29.89 7.05 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 178.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.523 ' HG3' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -96.66 61.3 1.89 Allowed 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 -176.204 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -166.92 45.25 0.06 Allowed 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.34 -1.3 . . . . 0.0 109.323 171.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -163.86 -37.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.205 -175.257 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -77.63 -31.06 52.57 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.783 -176.34 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 115.41 162.02 13.32 Favored Glycine 0 N--CA 1.439 -1.131 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -170.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -59.25 114.37 2.6 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 117.145 0.472 . . . . 0.0 111.389 -175.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -77.88 85.86 4.12 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.734 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.407 HG23 ' H ' ' A' ' 15' ' ' VAL . 0.0 OUTLIER -71.73 -6.45 7.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 121.263 0.554 . . . . 0.0 109.627 179.742 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.13 -32.48 50.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.82 174.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.531 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -72.3 172.71 9.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.411 0.624 . . . . 0.0 112.094 -168.452 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.49 -51.28 5.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.307 -179.037 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.6 t -103.63 138.4 40.34 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 169.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.717 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.8 mm-40 -118.98 132.44 56.07 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.469 0.652 . . . . 0.0 112.652 -167.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.413 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -138.59 119.49 14.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.625 169.235 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.439 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 5.9 t70 -156.64 -168.78 2.79 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 165.031 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.19 -29.31 70.68 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.736 0.779 . . . . 0.0 108.952 169.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.435 HD23 ' CD2' ' A' ' 27' ' ' TYR . 0.4 OUTLIER -89.07 14.66 10.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.667 -178.148 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.439 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -62.22 -37.99 87.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.623 0.249 . . . . 0.0 110.862 -178.61 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.85 -26.7 63.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.934 0.397 . . . . 0.0 111.011 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.435 ' CD2' HD23 ' A' ' 24' ' ' LEU . 58.5 t80 -67.42 -36.32 81.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.943 -178.683 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -100.72 -15.69 17.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.91 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 53.53 58.54 5.08 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.075 -178.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.7 m -148.77 48.42 1.01 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.472 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.717 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.63 138.08 34.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.908 0.385 . . . . 0.0 111.397 -176.987 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.13 162.23 28.69 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.837 177.322 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -27.22 68.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.257 0.551 . . . . 0.0 111.018 177.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.87 -10.29 59.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.37 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.451 ' CE2' ' HG3' ' A' ' 41' ' ' PRO . 31.7 t80 -67.33 -46.66 72.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.361 0.601 . . . . 0.0 110.048 -176.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.61 -29.35 62.32 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.64 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.87 -50.42 42.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.429 178.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.411 ' OE1' ' HA ' ' A' ' 38' ' ' GLU . 4.9 mm-40 -88.71 -43.26 11.43 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -173.24 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.0 t -84.33 -42.96 15.24 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.592 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.93 65.36 3.35 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.251 178.642 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.451 ' HG3' ' CE2' ' A' ' 35' ' ' TYR . 87.8 Cg_endo . . . . . 0 C--N 1.345 0.37 0 C-N-CA 122.375 2.05 . . . . 0.0 111.017 175.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.446 -0.641 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -85.44 138.33 32.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.794 -176.65 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -125.9 -52.1 1.56 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 173.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -166.22 43.26 0.27 Allowed Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.662 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.424 ' HD2' ' SG ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -95.44 12.42 29.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.412 0.625 . . . . 0.0 109.99 177.925 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -79.89 -2.59 44.3 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.433 179.624 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.94 -1.78 18.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.346 -178.426 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -98.49 -8.78 26.07 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.719 0.295 . . . . 0.0 110.743 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.68 162.32 35.96 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.138 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.579 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 4.5 t80 -74.77 106.87 6.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.278 0.561 . . . . 0.0 110.438 177.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.479 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -99.85 102.27 13.64 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.099 174.523 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.576 HG13 ' HE1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -78.54 41.13 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.12 0.486 . . . . 0.0 110.758 -175.569 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -166.69 24.32 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.033 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.479 ' HG2' ' HB3' ' A' ' 14' ' ' ASN . 9.0 mmtm -89.3 -103.44 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.175 0.512 . . . . 0.0 110.228 176.274 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.432 ' HG3' ' C ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -150.48 -56.06 0.16 Allowed 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.161 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -124.84 147.76 48.58 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.465 171.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.637 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 2.7 mp0 -125.32 131.66 53.0 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.898 0.38 . . . . 0.0 111.679 -171.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.46 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 11.4 m -137.88 118.98 14.42 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 170.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -152.1 -170.62 3.69 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -69.05 -30.92 69.36 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 167.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mt -85.66 14.99 5.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.843 -178.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.578 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -63.55 -39.49 94.54 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 178.401 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.99 -28.52 62.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.833 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -65.49 -47.37 76.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.708 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -89.33 -11.97 41.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.008 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 53.81 43.78 30.49 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.175 0.512 . . . . 0.0 110.516 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 m -139.55 58.59 1.61 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.874 -176.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.637 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -110.48 156.0 21.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.329 177.096 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.6 m -72.48 156.2 39.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.491 177.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -22.34 66.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.988 -177.214 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.46 21.48 12.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.107 -177.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.483 ' O ' ' HB2' ' A' ' 39' ' ' CYS . 20.8 t80 -60.82 -50.96 71.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.119 0.485 . . . . 0.0 110.683 -177.535 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.471 ' O ' ' HE2' ' A' ' 40' ' ' LYS . 0.8 OUTLIER -72.98 -30.27 63.68 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.381 -177.383 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.72 -46.33 66.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.655 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 71.6 mm-40 -95.86 -39.99 9.54 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -173.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 96.0 m -82.43 -44.45 16.05 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.808 -178.601 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.471 ' HE2' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 59.32 78.0 0.36 Allowed Pre-proline 0 CA--C 1.531 0.221 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.147 179.851 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo . . . . . 0 CA--C 1.531 0.354 0 C-N-CA 122.829 2.353 . . . . 0.0 112.589 -179.632 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.452 -0.36 0 CA-C-O 121.114 0.483 . . . . 0.0 111.315 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.559 ' H ' ' HB2' ' A' ' 34' ' ' ASP . 3.1 t -85.48 143.24 28.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.537 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.34 -89.83 0.51 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.851 0.358 . . . . 0.0 110.064 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.98 47.12 1.04 Allowed Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.711 -0.757 . . . . 0.0 111.646 178.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.468 ' HB2' ' NH1' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.27 8.23 36.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.112 0.482 . . . . 0.0 110.341 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.3 -15.04 48.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.35 0.595 . . . . 0.0 109.96 177.568 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.36 -10.12 59.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.177 -178.191 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -102.15 -5.89 23.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.546 178.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 79.15 -177.56 54.16 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.266 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -72.11 108.55 5.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.02 0.438 . . . . 0.0 110.798 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.42 ' C ' ' H ' ' A' ' 16' ' ' ASP . 2.0 t30 -99.14 105.57 17.66 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.583 172.129 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.405 HG23 ' H ' ' A' ' 15' ' ' VAL . 0.2 OUTLIER -78.8 41.28 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.667 0.746 . . . . 0.0 110.157 -179.127 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.42 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -128.35 -20.87 3.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.056 -0.974 . . . . 0.0 110.128 178.391 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 29.8 mmtm -91.31 -175.02 4.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.218 0.532 . . . . 0.0 111.495 -173.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.524 ' H ' ' HD2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -87.5 -69.52 0.68 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.248 -177.624 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.27 139.19 35.29 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 174.266 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.581 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -126.32 148.84 49.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.815 0.34 . . . . 0.0 110.886 -175.813 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 69.1 m -133.8 116.59 15.88 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 171.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.419 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 14.4 t70 -154.12 178.0 10.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.182 176.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.96 -27.21 64.55 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 168.753 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.404 ' N ' ' HG3' ' A' ' 23' ' ' GLU . 54.1 mt -82.46 14.7 2.88 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.406 178.034 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -58.63 -40.68 84.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.702 0.287 . . . . 0.0 110.743 -179.584 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -25.9 59.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.032 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -64.83 -49.4 70.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.584 -178.303 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -88.68 -15.92 33.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.844 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.69 48.85 5.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.308 -176.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 44.0 m -149.13 73.21 1.2 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.763 -178.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -114.42 149.01 36.86 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.021 177.004 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -75.63 152.76 37.57 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 175.934 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.85 -33.52 74.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -174.824 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.559 ' HB2' ' H ' ' A' ' 5' ' ' CYS . 0.8 OUTLIER -86.58 24.52 1.41 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.593 -176.568 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.482 ' O ' ' HB2' ' A' ' 39' ' ' CYS . 19.5 t80 -67.27 -50.72 59.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.231 0.539 . . . . 0.0 110.455 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.508 ' O ' ' HE3' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -73.65 -30.59 63.02 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.347 -175.783 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.69 -53.52 18.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.505 -178.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -90.76 -37.76 13.46 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -172.016 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 73.6 m -82.08 -55.93 4.26 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.179 -176.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.508 ' HE3' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 60.64 79.81 0.28 Allowed Pre-proline 0 N--CA 1.463 0.203 0 O-C-N 123.427 0.454 . . . . 0.0 110.904 179.609 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo . . . . . 0 CA--C 1.532 0.386 0 C-N-CA 123.119 2.546 . . . . 0.0 113.333 -176.566 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.655 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.575 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 1.6 t -87.91 142.82 27.5 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.834 0.35 . . . . 0.0 110.742 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.44 ' HA ' ' HG3' ' A' ' 38' ' ' GLU . 14.4 mmtt -134.58 -79.42 0.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.722 175.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -132.82 59.85 0.68 Allowed Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.025 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.564 ' NH2' ' HB3' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -128.44 28.76 5.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.054 0.454 . . . . 0.0 110.218 178.413 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.1 OUTLIER -110.46 -11.51 14.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.283 177.979 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.32 -12.48 40.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.506 -177.631 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -96.91 -18.37 19.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.724 -177.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 118.94 -176.55 16.12 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.473 -177.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.676 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 9.4 t80 -81.73 108.34 15.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.881 0.372 . . . . 0.0 110.62 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -79.14 94.16 5.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.013 174.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.496 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -86.11 36.03 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-O 121.286 0.565 . . . . 0.0 110.519 -177.972 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -138.06 -13.23 1.42 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.823 -176.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.439 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 1.0 OUTLIER -92.84 -172.27 2.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.229 0.538 . . . . 0.0 111.963 -170.554 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.21 -17.3 46.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.258 -179.166 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.564 ' HB3' ' NH2' ' A' ' 8' ' ' ARG . 5.6 t -162.81 142.12 8.94 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.091 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.582 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -127.44 150.97 49.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.78 0.324 . . . . 0.0 111.311 -171.281 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.511 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 86.9 m -142.1 117.73 10.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.271 173.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.463 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 17.5 t70 -153.81 -177.77 6.61 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 171.56 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -68.61 -28.97 67.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 167.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mt -77.39 12.12 1.68 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.508 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.676 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -57.34 -42.57 82.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.074 179.51 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.44 -27.16 60.48 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.916 0.389 . . . . 0.0 111.084 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -67.41 -44.26 79.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.404 -178.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -90.72 -16.06 29.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.932 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 56.9 54.34 7.21 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.138 -174.102 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.2 m -154.34 76.64 1.04 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.156 -178.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.582 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -125.16 148.48 48.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.505 176.789 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.575 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 5.4 m -70.89 154.37 41.88 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.555 175.148 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.99 -28.74 69.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.617 -178.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.74 21.56 4.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.045 -178.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -65.36 -47.33 76.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.762 0.792 . . . . 0.0 109.285 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.446 ' O ' ' HE2' ' A' ' 40' ' ' LYS . 0.5 OUTLIER -74.06 -29.71 62.03 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.014 -179.755 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.71 -40.6 76.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.853 -177.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.44 ' HG3' ' HA ' ' A' ' 6' ' ' LYS . 64.8 mm-40 -98.38 -51.01 4.11 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -175.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 4.3 m -73.52 -34.68 65.38 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -177.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.446 ' HE2' ' O ' ' A' ' 36' ' ' THR . 0.2 OUTLIER 52.04 75.54 0.64 Allowed Pre-proline 0 N--CA 1.465 0.287 0 O-C-N 123.66 0.6 . . . . 0.0 112.232 173.892 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo . . . . . 0 CA--C 1.529 0.264 0 C-N-CA 123.327 2.685 . . . . 0.0 111.748 176.562 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.7 m . . . . . 0 N--CA 1.446 -0.642 0 CA-C-O 121.1 0.476 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.636 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -78.55 127.64 32.43 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.094 178.539 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.453 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -98.71 -88.08 0.33 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.324 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.32 49.33 0.92 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 120.678 -0.772 . . . . 0.0 111.979 177.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.636 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 4.8 mmt85 -76.05 -6.83 52.9 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.826 0.346 . . . . 0.0 110.782 -175.403 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.413 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 23.7 m -79.53 -7.4 58.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.226 -176.219 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.54 -36.58 10.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.649 0.262 . . . . 0.0 111.062 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.39 -46.97 29.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.988 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 124.02 -178.69 16.37 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.013 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.665 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 4.0 t80 -79.53 108.5 13.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.879 0.371 . . . . 0.0 111.559 -178.134 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -94.44 105.09 17.05 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 168.21 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 t -64.41 -21.52 29.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.264 0.554 . . . . 0.0 109.916 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -94.54 41.04 1.09 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.074 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.472 ' HD2' ' HA ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -119.27 165.55 14.12 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 170.271 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.64 -19.51 27.62 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.336 0.589 . . . . 0.0 110.143 -176.119 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.7 t -146.55 139.47 25.41 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 175.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.617 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -130.15 142.39 50.59 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -171.053 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.455 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 66.1 m -138.18 117.32 12.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.546 167.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.458 ' H ' ' HB3' ' A' ' 25' ' ' CYS . 35.7 t0 -154.9 179.97 8.61 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 175.237 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -15.53 63.42 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 166.26 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.8 mt -89.9 0.25 57.17 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.376 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.665 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -66.27 -25.58 66.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.735 0.303 . . . . 0.0 110.802 -176.337 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -39.82 62.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.896 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -63.35 -40.37 97.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.972 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -88.44 -15.44 35.44 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.321 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 54.64 45.28 27.15 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.53 -177.645 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.27 70.19 1.22 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.185 -178.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.617 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -109.61 148.61 31.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.118 176.154 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 21.1 m -65.29 157.77 28.16 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.931 0.396 . . . . 0.0 111.496 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.38 -26.18 63.6 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.277 0.56 . . . . 0.0 110.85 178.613 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.61 15.86 13.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.254 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.594 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 16.2 t80 -71.23 -39.46 71.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.699 -178.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -35.27 65.86 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.981 -179.305 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.07 -48.28 58.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.931 -178.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -90.81 -42.87 10.41 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -174.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.594 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 35.9 t -82.42 -51.94 7.36 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.379 -175.342 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.405 ' HE3' ' HB2' ' A' ' 40' ' ' LYS . 0.4 OUTLIER 57.72 75.56 0.54 Allowed Pre-proline 0 CA--C 1.531 0.242 0 O-C-N 123.607 0.567 . . . . 0.0 111.151 176.719 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo . . . . . 0 C--N 1.348 0.507 0 C-N-CA 123.089 2.526 . . . . 0.0 112.65 179.944 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 C--O 1.236 0.359 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 2.6 t -80.33 138.18 36.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.801 0.334 . . . . 0.0 110.262 -178.187 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -134.28 -81.79 0.45 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.104 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -112.09 31.93 6.66 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 176.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.67 ' O ' ' HB2' ' A' ' 21' ' ' CYS . 2.9 mtt-85 -86.51 54.07 3.03 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 121.586 0.708 . . . . 0.0 109.87 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -150.64 18.64 0.81 Allowed 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 167.28 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.69 -36.65 0.21 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.924 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.525 ' HG2' ' HA ' ' A' ' 8' ' ' ARG . 17.2 pt-20 -68.6 -25.07 64.68 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.079 178.107 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 102.7 161.23 25.87 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.246 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.543 ' CE1' ' HG3' ' A' ' 20' ' ' GLN . 3.9 t80 -68.4 119.27 12.63 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.269 0.557 . . . . 0.0 110.607 178.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.548 ' HB3' ' HB2' ' A' ' 17' ' ' LYS . 4.2 t-20 -103.34 104.15 14.23 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.895 175.146 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -79.47 51.47 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 176.581 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -157.52 -41.99 0.07 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.671 -1.15 . . . . 0.0 109.475 -174.327 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.548 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -67.18 126.48 29.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.009 174.977 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.42 -59.26 1.63 Allowed 'General case' 0 N--CA 1.474 0.767 0 O-C-N 124.014 0.821 . . . . 0.0 113.172 -175.562 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -100.12 143.84 29.86 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 177.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.647 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.4 mm-40 -131.34 145.17 51.73 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.127 0.489 . . . . 0.0 112.108 -173.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.819 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 1.8 m -136.4 120.22 17.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.441 171.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.429 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 10.4 t70 -154.87 -171.49 3.85 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 172.542 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.04 -33.03 72.95 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 107.248 -1.389 . . . . 0.0 107.248 162.491 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.9 mp -77.85 14.39 1.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.557 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.429 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -65.59 -37.36 86.4 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 176.959 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -26.31 62.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.167 0.508 . . . . 0.0 110.582 176.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.403 ' HD2' ' CD2' ' A' ' 28' ' ' TYR . 91.7 t80 -66.34 -39.77 89.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.093 -178.19 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.403 ' CD2' ' HD2' ' A' ' 27' ' ' TYR . 43.6 m-85 -102.87 -8.68 20.54 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.657 0.265 . . . . 0.0 110.709 177.395 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 50.68 48.7 22.27 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.771 -177.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.6 m -140.22 54.34 1.63 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.51 -177.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.647 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.95 137.09 36.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.43 -178.316 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.23 151.77 43.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.943 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.9 -27.61 66.87 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -174.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.06 13.4 18.95 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.194 -176.387 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.819 ' CD1' ' HB3' ' A' ' 21' ' ' CYS . 3.3 t80 -63.86 -48.45 76.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.2 -178.673 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.07 -31.21 68.69 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.298 -177.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.58 -51.53 27.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.359 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -77.58 -49.52 14.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.983 -174.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 1.4 t -85.27 -54.49 4.57 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.85 -175.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 61.28 78.19 0.32 Allowed Pre-proline 0 C--O 1.233 0.225 0 O-C-N 123.49 0.494 . . . . 0.0 110.861 -177.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo . . . . . 0 C--N 1.347 0.455 0 C-N-CA 122.783 2.322 . . . . 0.0 112.313 179.783 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.315 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.557 ' HB2' ' HB2' ' A' ' 38' ' ' GLU . 87.0 m -65.74 153.45 41.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.432 0.634 . . . . 0.0 111.156 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.518 ' O ' ' HE3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -151.71 31.08 0.57 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.468 0.651 . . . . 0.0 109.397 175.995 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 80.58 33.4 31.14 Favored Glycine 0 N--CA 1.443 -0.84 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.806 -174.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -4.99 44.23 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.96 0.41 . . . . 0.0 110.288 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.598 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 35.3 m -68.7 1.74 3.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.162 177.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 p -86.26 -24.23 26.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.148 0.499 . . . . 0.0 110.319 176.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -98.76 -6.22 29.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.274 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.91 -166.76 34.13 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.316 -176.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.446 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 15.7 t80 -70.55 108.11 4.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.944 0.402 . . . . 0.0 110.822 178.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.439 HD21 ' HA ' ' A' ' 20' ' ' GLN . 0.5 OUTLIER -78.23 86.29 4.35 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.416 176.994 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.8 56.54 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.811 0.815 . . . . 0.0 109.571 177.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -155.01 -41.35 0.09 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.761 -1.109 . . . . 0.0 109.242 -176.283 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.549 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -76.17 173.02 11.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.846 -179.392 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.43 ' HB2' ' HE3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -85.59 -36.78 20.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.661 -174.718 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -111.5 138.73 47.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.688 174.718 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.536 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 18.9 mp0 -123.83 138.17 54.54 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.919 0.39 . . . . 0.0 111.195 -175.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.598 ' HB2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -139.7 117.35 11.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.138 0.494 . . . . 0.0 109.751 167.822 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.411 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 25.6 t0 -154.23 -176.57 5.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.086 -0.961 . . . . 0.0 108.691 175.635 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.52 -33.22 73.74 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 166.632 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.0 mt -75.51 14.43 0.61 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.799 178.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.436 ' HB2' ' HB3' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -61.57 -38.13 86.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.785 0.326 . . . . 0.0 110.194 -179.539 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.77 -26.52 59.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.113 178.31 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -64.94 -40.83 95.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.726 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -98.32 -13.35 20.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.651 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 55.56 48.88 17.76 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.477 0.656 . . . . 0.0 110.076 -174.137 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.427 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 27.3 m -149.3 76.85 1.34 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.945 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.536 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -120.74 150.96 40.16 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.931 176.617 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 3.5 m -70.81 144.25 50.87 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -29.55 69.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.895 0.378 . . . . 0.0 111.296 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -91.0 31.29 1.1 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.194 0.521 . . . . 0.0 110.957 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.4 ' HD1' ' HB3' ' A' ' 21' ' ' CYS . 17.8 t80 -65.52 -40.58 93.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.647 0.737 . . . . 0.0 109.652 179.204 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.446 ' HA ' ' HD2' ' A' ' 41' ' ' PRO . 0.1 OUTLIER -72.05 -34.08 68.49 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.726 179.73 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -71.12 -55.06 8.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.198 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.557 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 32.7 mt-10 -97.51 0.43 47.51 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -169.331 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -126.6 -36.74 2.22 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.444 173.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.24 74.87 0.51 Allowed Pre-proline 0 N--CA 1.465 0.29 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 171.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.446 ' HD2' ' HA ' ' A' ' 36' ' ' THR . 17.8 Cg_endo . . . . . 0 C--N 1.344 0.301 0 C-N-CA 122.275 1.984 . . . . 0.0 111.831 177.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.448 -0.555 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.517 ' H ' ' HB2' ' A' ' 34' ' ' ASP . 0.9 OUTLIER -84.39 154.13 23.02 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.629 -178.315 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.528 ' HG3' ' N ' ' A' ' 7' ' ' GLY . 0.0 OUTLIER -164.01 -33.77 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.91 177.388 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLY . . . . . 0.528 ' N ' ' HG3' ' A' ' 6' ' ' LYS . . . -154.47 63.35 0.35 Allowed Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.211 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.403 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -129.41 -37.34 1.63 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 175.623 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.4 -21.2 65.6 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.748 -178.042 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -85.69 -13.03 49.74 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.355 -176.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -111.16 -54.7 2.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.657 -177.46 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.99 -171.14 26.25 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.695 -0.765 . . . . 0.0 111.853 -179.095 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.705 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 3.2 t80 -83.61 112.48 20.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.921 0.391 . . . . 0.0 111.137 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.415 ' C ' ' H ' ' A' ' 16' ' ' ASP . 1.5 t30 -99.57 103.0 14.68 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 171.304 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.401 ' H ' HG23 ' A' ' 15' ' ' VAL . 0.2 OUTLIER -78.53 42.67 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.512 0.673 . . . . 0.0 109.962 -177.812 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -128.8 -27.66 2.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.405 -178.555 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.513 ' HB2' ' OE1' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -87.15 -165.58 1.34 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.786 -177.37 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.46 -61.88 1.47 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.186 -178.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -110.22 138.88 46.0 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.273 0.558 . . . . 0.0 109.86 176.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.643 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 4.2 mp0 -120.32 152.42 37.85 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.622 -177.05 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.471 ' HB3' ' CD2' ' A' ' 35' ' ' TYR . 86.2 m -123.12 113.44 18.98 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 168.167 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.497 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 13.1 t70 -156.66 179.04 9.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.995 178.564 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.46 -35.53 75.72 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 165.555 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.1 mt -77.11 9.38 3.07 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.654 -179.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.705 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -60.86 -41.74 96.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.169 -175.963 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.66 -29.89 63.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.247 -177.003 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -62.85 -48.92 76.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.782 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -84.0 -15.16 48.69 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.226 177.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.82 45.35 15.57 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.611 -178.01 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -138.17 63.03 1.55 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.465 -178.275 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.643 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -102.77 153.28 20.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.875 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.451 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 1.9 m -82.16 139.08 34.54 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 171.5 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -21.91 65.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.278 0.561 . . . . 0.0 111.474 -177.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.517 ' HB2' ' H ' ' A' ' 5' ' ' CYS . 0.7 OUTLIER -86.04 17.85 3.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.237 -175.345 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.471 ' CD2' ' HB3' ' A' ' 21' ' ' CYS . 15.0 t80 -64.53 -55.57 19.7 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.369 0.605 . . . . 0.0 110.409 -178.309 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.2 p -70.62 -29.03 65.3 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.254 -175.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -68.47 -55.08 13.01 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.892 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -91.36 -50.98 5.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.3 m -71.53 -47.27 56.27 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 121.225 -0.19 . . . . 0.0 111.055 -173.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 mtpp 59.36 77.5 0.39 Allowed Pre-proline 0 N--CA 1.464 0.231 0 O-C-N 123.409 0.443 . . . . 0.0 110.569 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo . . . . . 0 C--N 1.343 0.279 0 C-N-CA 123.313 2.675 . . . . 0.0 112.573 -175.362 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.552 ' HA ' ' HB2' ' A' ' 34' ' ' ASP . 0.8 OUTLIER . . . . . 0 N--CA 1.448 -0.527 0 CA-C-O 120.998 0.428 . . . . 0.0 110.857 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.473 ' HB3' ' HG3' ' A' ' 8' ' ' ARG . 2.8 m -77.97 119.7 21.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.904 177.356 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 mtmt -119.76 -54.77 2.13 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 176.193 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.88 -17.85 42.62 Favored Glycine 0 N--CA 1.44 -1.079 0 CA-C-N 115.276 -0.875 . . . . 0.0 112.349 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.473 ' HG3' ' HB3' ' A' ' 5' ' ' CYS . 0.1 OUTLIER -98.62 40.85 1.17 Allowed 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 122.025 -0.691 . . . . 0.0 110.501 -173.456 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.636 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.8 OUTLIER -131.44 -7.29 3.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.455 177.007 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.39 2.47 8.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.72 -174.573 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -104.68 12.21 33.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.225 0.536 . . . . 0.0 110.389 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 86.75 -173.29 45.2 Favored Glycine 0 N--CA 1.442 -0.953 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.601 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 7.9 t80 -93.73 107.13 19.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.691 0.282 . . . . 0.0 110.439 -178.678 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.36 95.25 8.68 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.851 173.678 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.452 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -80.78 41.32 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.522 0.677 . . . . 0.0 110.115 -178.314 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -134.31 -13.26 2.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.051 -178.335 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 13.9 mmtm -91.85 179.3 5.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.143 0.497 . . . . 0.0 111.904 -170.302 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.92 -29.88 28.86 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.622 -178.394 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -140.01 149.45 43.23 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.601 ' HG2' ' CE1' ' A' ' 13' ' ' PHE . 13.4 mp0 -130.73 146.09 52.11 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.999 -174.265 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.636 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 4.1 m -143.88 117.79 9.38 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 169.781 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.591 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 17.6 t70 -154.64 -179.35 7.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -69.12 -29.48 67.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 166.256 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 50.5 mt -79.56 14.42 1.65 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.167 176.451 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.591 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -63.28 -39.32 94.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.706 -0.225 . . . . 0.0 110.548 -179.867 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.95 -28.27 61.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.131 -179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -64.15 -52.32 59.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.664 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -85.18 -16.17 41.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.927 -179.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.0 44.64 22.52 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.98 -179.326 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.6 m -141.77 56.74 1.5 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.192 -177.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.549 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.1 OUTLIER -108.76 146.03 34.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.663 179.131 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 m -69.55 156.88 38.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.891 179.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -28.57 69.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.968 0.413 . . . . 0.0 111.989 -177.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.552 ' HB2' ' HA ' ' A' ' 4' ' ' SER . 2.5 m-20 -85.25 13.97 5.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.293 -175.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.46 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 46.3 t80 -66.72 -50.5 62.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.094 0.473 . . . . 0.0 110.637 -177.709 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.477 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -70.63 -28.61 64.95 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.104 -178.224 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.52 -52.75 50.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.969 178.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -89.63 -53.74 4.39 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -71.01 -44.37 66.01 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.696 -172.786 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' A' ' 36' ' ' THR . 0.2 OUTLIER 58.07 85.1 0.19 Allowed Pre-proline 0 N--CA 1.465 0.323 0 O-C-N 123.712 0.632 . . . . 0.0 112.088 176.861 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.463 -0.267 0 C-N-CA 122.474 2.116 . . . . 0.0 111.501 176.479 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 74.0 m . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 120.814 0.34 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.635 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 44.4 t -83.05 149.87 26.67 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.358 -178.288 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -162.48 -64.26 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 123.555 0.535 . . . . 0.0 110.179 173.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.81 34.16 4.8 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.422 -173.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.477 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 2.2 mmp_? -98.97 -32.95 11.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.419 0.61 . . . . 0.0 110.149 175.032 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.465 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 1.0 OUTLIER -68.55 -21.69 64.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.416 -175.021 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.58 -27.52 45.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.265 -177.373 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.95 -50.31 4.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.891 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 135.77 -156.97 23.09 Favored Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 111.296 -0.722 . . . . 0.0 111.296 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.57 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 3.9 t80 -84.29 107.83 16.8 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.132 0.491 . . . . 0.0 110.915 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.415 ' C ' ' H ' ' A' ' 16' ' ' ASP . 0.2 OUTLIER -89.63 93.04 9.32 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.589 173.507 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.419 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -78.47 35.97 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.131 0.491 . . . . 0.0 110.885 -176.634 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.2 OUTLIER -133.37 2.3 3.53 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.114 177.569 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.5 mmpp? -109.08 -169.52 1.5 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.311 -178.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.17 -63.79 1.11 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.452 -178.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.08 138.57 35.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.941 177.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.57 ' HG2' ' CE1' ' A' ' 13' ' ' PHE . 2.3 mp0 -129.08 145.61 51.23 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.271 -174.225 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.2 m -135.57 116.36 14.03 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 168.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -155.04 179.16 9.41 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.449 -0.796 . . . . 0.0 108.994 174.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.58 -22.07 63.56 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 167.725 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.6 mt -81.24 10.9 4.78 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.367 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -38.13 86.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.739 0.305 . . . . 0.0 110.567 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -26.8 65.65 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.403 179.59 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -77.81 -52.37 9.0 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.377 -176.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.405 ' HB2' ' CZ ' ' A' ' 13' ' ' PHE . 50.5 m-85 -88.25 -16.69 32.52 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.347 -177.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 72.8 mm-40 53.89 54.45 9.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.308 0.575 . . . . 0.0 111.028 -177.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.34 39.51 3.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.766 -178.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -98.53 147.58 24.62 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.226 -177.25 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.635 ' SG ' ' HB2' ' A' ' 5' ' ' CYS . 1.9 m -77.98 164.13 25.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.164 178.715 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.62 -38.11 86.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.931 -177.102 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.43 32.88 1.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.21 0.529 . . . . 0.0 110.929 -178.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.465 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 16.8 t80 -72.17 -41.75 66.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.5 0.667 . . . . 0.0 109.676 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -30.09 70.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.236 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.21 -54.63 11.99 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.258 177.283 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.618 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 46.3 mm-40 -68.73 -53.13 23.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.829 -175.662 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.519 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 0.5 OUTLIER -73.15 -48.79 32.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.524 -177.805 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.68 61.33 12.6 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.935 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.519 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 64.8 Cg_endo . . . . . 0 N--CA 1.458 -0.603 0 C-N-CA 121.902 1.735 . . . . 0.0 111.526 177.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.521 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.494 ' HB3' ' HG2' ' A' ' 38' ' ' GLU . 30.0 m -112.13 122.07 46.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 176.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.454 ' HE2' ' O ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -146.58 28.91 1.05 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.063 0.459 . . . . 0.0 110.567 -178.501 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 141.97 26.28 0.18 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.799 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.43 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.2 OUTLIER -82.37 -27.38 32.15 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.494 ' HB2' ' OE1' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -70.1 -18.49 63.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.27 0.557 . . . . 0.0 110.208 -179.921 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -107.48 -11.38 15.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.355 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.92 -16.94 14.71 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.067 0.461 . . . . 0.0 110.683 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 112.67 146.05 9.75 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.812 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.561 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 10.0 t80 -56.22 107.36 0.36 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.454 0.645 . . . . 0.0 110.655 178.312 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.534 HD21 ' HA ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -83.66 81.92 8.54 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.45 179.307 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.415 HG23 ' H ' ' A' ' 15' ' ' VAL . 0.0 OUTLIER -69.97 -1.18 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.053 0.454 . . . . 0.0 110.412 -178.672 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.56 -9.28 25.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.193 179.728 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.409 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -96.63 -176.63 3.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.795 0.331 . . . . 0.0 111.344 -176.084 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -82.03 -56.09 4.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.649 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.43 138.23 48.19 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.616 -0.512 . . . . 0.0 109.616 176.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.652 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -127.82 149.63 50.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.278 -171.942 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 53.8 m -144.92 119.37 9.65 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.343 174.436 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.491 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 6.8 t0 -153.1 -174.8 5.07 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 169.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -68.29 -21.89 64.76 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 170.065 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -86.41 14.47 6.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.99 177.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.561 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -59.41 -40.96 88.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.611 178.979 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -26.03 60.64 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.004 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -66.21 -45.64 80.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.63 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -90.91 -17.0 27.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.769 0.319 . . . . 0.0 110.745 178.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 52.81 50.36 18.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.573 -174.174 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -142.04 48.24 1.6 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.079 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.652 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.64 146.77 24.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.799 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.23 160.77 27.74 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.397 177.428 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -29.5 70.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.938 -178.368 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -85.82 28.25 0.8 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.749 0.309 . . . . 0.0 111.234 -179.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -70.51 -47.58 59.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.459 0.647 . . . . 0.0 110.082 -178.295 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -28.88 66.42 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.997 -178.069 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.98 -48.96 74.35 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.747 178.777 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.494 ' HG2' ' HB3' ' A' ' 5' ' ' CYS . 0.3 OUTLIER -87.58 -40.39 14.27 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.484 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.43 ' N ' ' HG3' ' A' ' 38' ' ' GLU . 49.1 t -91.81 -55.57 3.42 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.333 -175.041 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 tttt 47.85 67.41 4.51 Favored Pre-proline 0 N--CA 1.465 0.299 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.119 -173.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo . . . . . 0 C--N 1.343 0.271 0 C-N-CA 122.579 2.186 . . . . 0.0 111.515 179.952 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 121.197 0.522 . . . . 0.0 110.836 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 3.5 t -82.93 118.6 23.58 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.418 -176.335 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.438 ' HE2' ' O ' ' A' ' 5' ' ' CYS . 13.5 mmtt -141.63 -60.98 0.47 Allowed 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 175.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -128.32 51.68 0.85 Allowed Glycine 0 N--CA 1.444 -0.794 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.851 176.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.53 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -91.71 -21.1 20.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.113 0.482 . . . . 0.0 109.761 177.004 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -76.54 -18.12 58.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.76 -176.463 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.76 -21.16 41.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.765 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.6 -42.22 6.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.18 -179.41 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 122.1 179.54 15.97 Favored Glycine 0 N--CA 1.444 -0.768 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 -177.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.713 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 6.6 t80 -62.36 107.11 0.85 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.185 0.517 . . . . 0.0 110.635 177.538 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.426 ' ND2' ' HB2' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -89.3 84.59 6.48 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.852 176.161 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.462 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -68.45 -14.48 18.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.2 0.524 . . . . 0.0 109.902 -177.955 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -21.44 54.81 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.224 177.28 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.426 ' HB2' ' ND2' ' A' ' 14' ' ' ASN . 1.7 mmpp? -84.02 171.2 13.16 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.14 -9.87 37.9 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.117 0.484 . . . . 0.0 110.36 -179.011 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -137.2 138.2 39.93 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 172.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.576 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 26.7 mp0 -131.8 148.03 52.53 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.844 0.354 . . . . 0.0 111.86 -169.349 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.53 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 64.8 m -142.34 118.26 10.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.725 170.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -153.3 -173.7 4.67 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 167.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -19.46 63.74 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 169.468 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 mt -88.44 14.62 9.3 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.252 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.713 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -60.73 -37.38 81.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.68 0.276 . . . . 0.0 110.776 -178.578 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -26.7 60.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.245 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -68.46 -44.07 75.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.582 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -88.43 -15.75 34.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.406 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 56.8 49.5 14.14 Favored 'General case' 0 CA--C 1.522 -0.1 0 O-C-N 123.713 0.633 . . . . 0.0 110.152 -176.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.2 m -151.39 76.47 1.22 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.224 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -118.67 151.5 37.84 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.994 176.179 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 3.3 m -80.11 160.12 25.85 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.91 0.386 . . . . 0.0 110.967 177.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -26.92 68.89 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.142 0.496 . . . . 0.0 111.317 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.61 7.34 36.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.486 -177.435 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.468 ' CD1' ' HB3' ' A' ' 21' ' ' CYS . 13.5 t80 -62.59 -47.18 84.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.323 0.582 . . . . 0.0 110.123 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -32.97 63.94 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.057 -178.316 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.89 -50.45 34.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.036 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -93.1 -35.63 13.1 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -172.089 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 69.6 m -97.03 -55.17 2.95 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.428 -177.338 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 64.95 102.85 0.03 OUTLIER Pre-proline 0 C--O 1.232 0.153 0 O-C-N 123.612 0.57 . . . . 0.0 110.868 179.237 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo . . . . . 0 C--O 1.232 0.188 0 C-N-CA 123.071 2.514 . . . . 0.0 111.998 179.622 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.519 0 CA-C-O 121.387 0.613 . . . . 0.0 111.944 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.406 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 6.1 t -92.49 142.55 27.29 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.687 175.877 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.423 ' HB2' ' HE2' ' A' ' 6' ' ' LYS . 12.6 mtmm -118.82 -78.02 0.58 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.901 0.382 . . . . 0.0 110.328 178.108 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -143.19 31.63 1.94 Allowed Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.512 -0.851 . . . . 0.0 111.884 -176.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -82.33 8.95 9.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.867 0.365 . . . . 0.0 111.188 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.478 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 25.9 m -74.66 -16.69 60.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.44 0.638 . . . . 0.0 109.563 176.485 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -110.1 10.8 23.96 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.286 -177.184 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -110.45 11.92 23.07 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.697 0.761 . . . . 0.0 109.439 175.438 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.93 161.4 32.22 Favored Glycine 0 N--CA 1.445 -0.764 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.2 -177.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -73.56 107.2 5.69 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.287 175.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.478 HD21 ' HA ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -83.81 112.18 19.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.023 178.363 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -90.57 3.51 6.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.023 0.44 . . . . 0.0 110.555 -177.614 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -138.73 53.45 1.77 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.233 0.54 . . . . 0.0 110.88 177.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.445 ' CG ' ' HB2' ' A' ' 14' ' ' ASN . 6.8 mmmm -129.51 -171.3 2.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.8 172.4 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.2 -58.42 4.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.27 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -132.05 153.41 50.45 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.515 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.523 ' HG2' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -126.7 141.7 51.76 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -171.899 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.478 ' HB3' ' SG ' ' A' ' 9' ' ' CYS . 92.7 m -139.15 119.3 13.56 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.875 0.369 . . . . 0.0 110.986 174.626 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 19.2 t70 -153.93 -172.96 4.39 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 168.29 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.37 -23.8 63.79 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 167.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.1 mt -80.5 8.92 6.72 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.346 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.442 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -61.13 -39.1 88.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.879 0.371 . . . . 0.0 110.066 179.367 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.85 -26.66 62.45 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.104 178.589 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -66.85 -42.09 86.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.68 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -96.1 -17.5 20.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.03 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 55.47 47.06 21.87 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.101 0.477 . . . . 0.0 110.941 -175.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.523 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 0.3 OUTLIER -141.94 46.73 1.65 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.183 -178.197 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -95.29 153.71 17.54 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.593 179.815 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.42 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -66.62 156.41 35.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.582 179.08 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -37.71 75.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -172.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.425 ' HB2' ' HB3' ' A' ' 37' ' ' ALA . 9.8 p30 -103.39 31.74 4.18 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.982 0.42 . . . . 0.0 110.979 -175.358 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.603 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 7.9 t80 -62.59 -42.88 99.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.492 0.663 . . . . 0.0 109.265 178.032 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.541 ' O ' ' HD3' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -73.35 -32.4 64.51 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.85 179.724 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.425 ' HB3' ' HB2' ' A' ' 34' ' ' ASP . . . -66.61 -57.62 6.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.527 -178.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -87.17 -41.9 13.4 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.187 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.603 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 52.0 t -78.94 -46.8 17.61 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.401 -175.555 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.541 ' HD3' ' O ' ' A' ' 36' ' ' THR . 0.3 OUTLIER 55.3 75.4 0.6 Allowed Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.891 177.206 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo . . . . . 0 C--N 1.344 0.337 0 C-N-CA 123.451 2.767 . . . . 0.0 112.545 -178.672 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.45 -0.472 0 CA-C-O 121.723 0.773 . . . . 0.0 112.268 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 38.5 t -91.28 125.17 35.96 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.189 177.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.78 4.98 43.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.266 0.555 . . . . 0.0 110.021 177.257 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLY . . . . . 0.601 ' HA2' ' SG ' ' A' ' 39' ' ' CYS . . . 114.71 55.84 0.38 Allowed Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.561 -174.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.666 ' HG3' ' SG ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -84.08 7.14 19.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.469 0.652 . . . . 0.0 109.953 -178.908 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.477 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 16.4 m -72.34 -3.79 25.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.348 176.743 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 15.7 p -79.77 -24.61 41.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.474 0.654 . . . . 0.0 109.715 172.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -95.57 -22.8 17.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.493 -177.452 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.72 177.0 45.46 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 -176.669 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.696 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 4.0 t80 -72.87 108.39 5.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.145 0.497 . . . . 0.0 110.741 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.538 ' HB3' ' HB2' ' A' ' 17' ' ' LYS . 7.6 t-20 -96.74 106.97 19.35 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 172.63 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -75.49 -3.77 5.26 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.228 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -94.11 -6.86 44.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.752 176.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.538 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -94.69 159.95 14.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.843 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.585 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -84.53 -34.24 23.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.774 0.321 . . . . 0.0 110.567 -174.85 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -120.0 138.44 53.49 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 171.218 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.584 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 22.1 mp0 -127.01 140.89 51.97 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.735 -173.549 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.666 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -135.1 115.59 13.61 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.171 167.429 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.602 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 24.8 t70 -155.78 179.35 9.28 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.031 173.095 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -68.63 -26.76 65.51 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 168.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mt -76.95 5.89 7.18 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.466 177.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.696 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -61.34 -38.44 86.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.828 0.346 . . . . 0.0 110.547 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.99 -27.51 64.76 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.914 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -70.7 -46.87 62.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.903 -178.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -88.21 -12.79 42.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.658 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 55.17 47.67 21.21 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 121.639 0.733 . . . . 0.0 109.643 -174.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 16.5 m -145.12 77.76 1.53 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.189 -177.192 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.584 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -126.8 151.18 48.63 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.333 175.378 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.6 m -73.85 141.43 46.13 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 172.466 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -31.59 64.08 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -174.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.42 21.93 1.36 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.444 -177.409 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.477 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 19.2 t80 -67.99 -49.37 62.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.301 0.572 . . . . 0.0 110.324 -177.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.433 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 0.3 OUTLIER -73.6 -29.98 62.72 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.648 -176.427 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.87 -45.79 66.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.517 177.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -89.02 -53.91 4.37 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -174.217 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.601 ' SG ' ' HA2' ' A' ' 7' ' ' GLY . 1.4 m -76.2 -40.21 52.84 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.365 -175.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.76 92.05 0.07 OUTLIER Pre-proline 0 N--CA 1.464 0.237 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.386 175.258 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 36' ' ' THR . 2.4 Cg_endo . . . . . 0 N--CA 1.458 -0.611 0 C-N-CA 123.028 2.486 . . . . 0.0 111.365 175.179 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.328 0 CA-C-O 121.016 0.436 . . . . 0.0 111.649 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.792 ' SG ' ' HB2' ' A' ' 32' ' ' CYS . 84.0 m -97.55 162.83 13.11 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 168.442 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.48 -101.3 0.09 Allowed 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.851 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -96.13 4.79 65.33 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.217 -0.753 . . . . 0.0 111.217 -177.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.489 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 5.5 ptt-85 -79.61 66.77 5.18 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 122.063 0.935 . . . . 0.0 108.988 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.465 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -148.11 10.87 0.91 Allowed 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.744 166.685 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -145.9 9.93 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.59 177.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.424 ' HG3' ' HA ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -104.87 -27.49 11.69 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.75 -175.838 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 119.2 145.49 7.65 Favored Glycine 0 N--CA 1.444 -0.832 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 -173.02 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.67 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 12.9 t80 -69.91 107.37 3.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 121.312 0.577 . . . . 0.0 110.716 -174.77 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -84.55 97.62 9.68 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.421 174.41 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.654 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -87.32 28.83 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.216 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -135.87 19.58 3.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.515 -175.368 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.89 -176.1 2.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.605 179.573 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.93 -60.39 2.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.4 t -100.26 138.88 36.73 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 172.082 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.575 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.1 mp0 -108.6 135.35 50.0 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.923 0.392 . . . . 0.0 110.279 -175.075 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.516 ' SG ' ' HD1' ' A' ' 35' ' ' TYR . 0.8 OUTLIER -156.3 122.23 4.94 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.946 175.127 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.465 ' HA ' ' HA ' ' A' ' 9' ' ' CYS . 3.4 t70 -155.83 -169.03 2.96 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 160.495 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -14.53 62.96 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.181 0.515 . . . . 0.0 110.154 174.092 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.78 12.38 30.22 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.227 179.357 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.67 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -54.57 -40.45 68.79 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.634 0.254 . . . . 0.0 111.309 178.861 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -37.38 78.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.917 0.389 . . . . 0.0 111.028 -179.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -62.54 -48.31 80.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.679 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -81.83 -15.7 53.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.108 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 56.09 47.65 19.21 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.506 0.669 . . . . 0.0 110.334 -176.609 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.0 m -150.68 77.21 1.28 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.971 -177.323 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.575 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -125.9 157.26 38.15 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.27 174.994 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.792 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 2.6 m -71.02 158.84 35.81 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 174.452 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.12 -29.69 69.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.965 -173.218 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -94.38 32.97 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.483 0.658 . . . . 0.0 111.047 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.516 ' HD1' ' SG ' ' A' ' 21' ' ' CYS . 45.6 t80 -62.18 -38.72 90.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.583 179.297 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.535 ' O ' ' HA ' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -69.96 -29.01 66.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.986 -179.814 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.72 -45.73 67.54 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.143 0.497 . . . . 0.0 111.006 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -82.11 -51.33 8.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.084 -175.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.6 t -75.65 -41.35 54.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.912 0.387 . . . . 0.0 110.206 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.535 ' HA ' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 63.19 66.59 1.16 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.277 -0.874 . . . . 0.0 113.038 175.875 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo . . . . . 0 N--CA 1.455 -0.764 0 C-N-CA 122.205 1.937 . . . . 0.0 110.617 170.176 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.442 -0.857 0 CA-C-O 121.03 0.443 . . . . 0.0 110.074 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.448 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -64.94 120.84 13.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.739 -178.975 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.66 -70.7 0.76 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 173.812 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.26 61.15 0.63 Allowed Glycine 0 N--CA 1.439 -1.113 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.364 177.096 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.8 ptp180 -130.62 8.27 4.92 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.837 0.351 . . . . 0.0 110.176 175.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.735 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 83.5 m -103.18 19.55 19.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.634 0.731 . . . . 0.0 109.486 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.84 -46.7 1.97 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.069 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.54 -54.18 46.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.84 174.08 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 149.88 175.39 22.04 Favored Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 121.058 -0.592 . . . . 0.0 111.765 -179.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.581 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 30.0 t80 -65.81 113.91 4.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.163 0.506 . . . . 0.0 111.185 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.662 HD21 ' HA ' ' A' ' 20' ' ' GLN . 0.7 OUTLIER -81.89 116.04 21.36 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.667 172.125 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.401 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.2 OUTLIER -97.85 -11.34 8.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-O 121.439 0.637 . . . . 0.0 109.398 177.324 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -33.92 37.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.38 179.184 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 3.1 mmtm -70.69 -178.64 1.9 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.167 0.508 . . . . 0.0 111.96 -174.304 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.82 -47.25 7.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.725 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -109.55 139.49 44.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.491 174.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.699 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -123.2 142.16 51.2 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 120.826 0.346 . . . . 0.0 111.385 -174.089 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.735 ' HB3' ' SG ' ' A' ' 9' ' ' CYS . 1.3 m -145.82 115.9 7.42 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.048 172.385 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.619 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 21.3 t70 -156.39 -176.95 6.24 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.422 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.6 -33.92 75.97 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 166.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.63 5.24 3.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.884 178.927 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.619 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -64.33 -33.63 76.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 -179.631 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.09 -25.92 64.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.783 178.617 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -73.19 -34.18 65.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.942 -178.295 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -102.9 -16.39 15.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.673 0.273 . . . . 0.0 111.134 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 59.11 36.47 24.13 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.397 -178.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -133.07 51.84 2.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.404 -177.281 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.699 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -97.51 148.27 23.41 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.338 177.902 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.441 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 1.8 m -74.53 162.22 29.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.658 178.307 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.46 -25.19 67.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.929 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.37 12.06 9.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.66 -176.725 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.435 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 31.0 t80 -63.53 -50.28 70.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.558 0.694 . . . . 0.0 110.754 -176.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -29.52 62.17 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.326 -176.45 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.69 -54.51 18.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.089 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -84.06 -53.27 5.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 0.0 112.034 -174.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.8 m -77.7 -47.95 17.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.182 -171.54 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.94 73.09 0.89 Allowed Pre-proline 0 N--CA 1.465 0.316 0 O-C-N 123.541 0.525 . . . . 0.0 111.395 178.015 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo . . . . . 0 C--N 1.343 0.28 0 C-N-CA 122.561 2.174 . . . . 0.0 112.223 -179.135 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.35 0 CA-C-O 120.952 0.406 . . . . 0.0 111.2 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.458 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 4.7 t -99.34 169.3 9.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.365 178.849 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.544 ' HG3' ' N ' ' A' ' 7' ' ' GLY . 0.5 OUTLIER 176.96 -36.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.844 175.149 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLY . . . . . 0.544 ' N ' ' HG3' ' A' ' 6' ' ' LYS . . . -147.89 62.27 0.44 Allowed Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.832 -0.699 . . . . 0.0 111.955 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.613 ' HG3' ' SG ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -120.91 -40.14 2.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.99 0.424 . . . . 0.0 110.022 174.253 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 33.4 m -64.26 -19.66 65.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.256 0.551 . . . . 0.0 110.4 179.148 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -81.27 -15.08 56.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.64 -178.004 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.403 ' H ' ' HG2' ' A' ' 11' ' ' GLU . 0.1 OUTLIER -121.93 -4.75 9.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.738 -176.533 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.7 -175.16 51.98 Favored Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 111.321 -0.712 . . . . 0.0 111.321 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -69.4 109.74 4.34 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.224 0.535 . . . . 0.0 111.619 -177.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -92.21 102.07 14.58 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.088 169.257 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -78.32 47.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.962 0.886 . . . . 0.0 109.968 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -138.09 -35.42 0.63 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.771 -179.108 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.518 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -71.13 166.93 20.39 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.652 -174.986 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.3 -37.13 16.24 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.861 -175.635 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -103.98 137.63 41.68 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 172.394 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.543 ' HB2' ' O ' ' A' ' 30' ' ' SER . 24.2 mp0 -121.63 121.79 38.16 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.243 -173.5 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.613 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -139.57 115.45 10.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.993 0.425 . . . . 0.0 110.116 170.599 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -155.99 -175.17 5.29 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -68.75 -32.36 72.07 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 165.27 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.7 mt -78.68 7.39 6.96 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.816 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.17 -33.8 76.88 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -26.86 62.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.588 178.685 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.423 ' HD2' ' CE1' ' A' ' 28' ' ' TYR . 35.7 t80 -67.97 -43.8 78.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.607 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.423 ' CE1' ' HD2' ' A' ' 27' ' ' TYR . 93.8 m-85 -86.29 -16.06 38.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.848 0.356 . . . . 0.0 110.551 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 60.82 38.58 17.88 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.603 -178.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.543 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 5.7 m -145.5 72.85 1.33 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.316 -177.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -101.09 156.94 17.12 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.164 177.161 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 58.7 m -62.88 144.94 56.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.549 175.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.91 -26.98 67.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.184 178.449 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.05 26.57 7.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.76 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.494 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 11.6 t80 -65.93 -38.34 88.41 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.509 0.671 . . . . 0.0 109.633 -177.495 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.15 -33.77 63.63 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.184 178.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.61 -50.17 39.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.84 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -87.81 -45.97 9.85 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.149 -173.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.494 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 35.3 t -88.28 -37.08 16.32 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.915 -0.314 . . . . 0.0 111.06 -173.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt 62.46 84.6 0.19 Allowed Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 112.659 0.615 . . . . 0.0 112.659 172.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo . . . . . 0 CA--C 1.534 0.525 0 C-N-CA 123.134 2.556 . . . . 0.0 112.385 175.458 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 11.7 t70 . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.679 0.276 . . . . 0.0 110.683 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 15.2 mp0 -77.54 51.99 0.94 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.223 0.535 . . . . 0.0 111.823 -174.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.449 ' HB3' ' HD3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -114.64 16.6 17.5 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 174.147 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.69 164.51 9.7 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.481 -178.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.493 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 1.2 m -91.99 128.3 37.78 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-O 120.959 0.409 . . . . 0.0 111.356 -178.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.93 -99.02 0.34 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.884 175.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.68 6.84 74.23 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.948 -177.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.533 ' HA ' ' OE1' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -85.94 45.54 1.23 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.147 0.498 . . . . 0.0 110.078 -176.423 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.3 t -133.76 17.06 3.91 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.603 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.73 -38.01 2.42 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.588 -176.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.533 ' OE1' ' HA ' ' A' ' 8' ' ' ARG . 2.4 pm0 -72.92 -26.58 61.45 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.818 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 126.59 175.07 14.01 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.654 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.41 ' HD2' ' HB3' ' A' ' 22' ' ' ASP . 18.5 t80 -68.5 116.04 8.6 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.9 0.381 . . . . 0.0 111.334 -176.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -79.47 97.84 6.57 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 170.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -80.07 -2.86 5.77 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-O 121.304 0.573 . . . . 0.0 109.644 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -119.79 46.79 1.86 Allowed 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.384 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.58 172.11 12.29 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 171.293 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.449 ' HD3' ' HB3' ' A' ' 3' ' ' GLU . 0.0 OUTLIER -80.13 -21.79 42.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.225 0.536 . . . . 0.0 110.171 178.974 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 t -149.18 138.48 21.54 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.027 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.575 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -130.68 151.98 50.53 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -168.151 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.5 m -142.46 120.13 11.83 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.573 172.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.538 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 28.7 t0 -154.31 -179.54 8.03 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 170.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.62 -22.54 65.33 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 167.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.6 mt -85.53 14.21 5.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.119 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.538 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -61.23 -39.3 89.8 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 178.707 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.29 -25.96 59.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.799 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -67.5 -47.83 68.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.731 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -90.04 -16.06 30.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.641 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 58.86 50.53 8.43 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.423 0.63 . . . . 0.0 110.085 -173.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -147.92 78.22 1.44 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.506 -177.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.575 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.1 OUTLIER -127.73 147.42 50.4 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.325 175.162 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 5' ' ' CYS . 4.1 m -73.84 169.42 17.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.156 0.503 . . . . 0.0 111.741 178.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.65 -28.27 64.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.471 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.493 ' OD1' ' HB2' ' A' ' 5' ' ' CYS . 0.4 OUTLIER -89.56 17.05 6.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.763 0.316 . . . . 0.0 110.772 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -67.11 -48.03 69.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.564 0.697 . . . . 0.0 109.579 178.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -29.72 64.22 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.752 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.99 -57.79 4.59 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.388 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 24.5 mm-40 -78.96 -42.6 26.41 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -173.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.1 t -84.12 -55.4 4.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.363 -174.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 mttt 61.52 76.16 0.41 Allowed Pre-proline 0 N--CA 1.467 0.408 0 CA-C-O 121.103 0.478 . . . . 0.0 110.429 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -75.02 -12.04 21.46 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.67 2.246 . . . . 0.0 113.402 -174.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 64.46 71.19 0.48 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.004 0.43 . . . . 0.0 110.729 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.58 HG12 ' HA2' ' A' ' 46' ' ' GLY . 2.6 t -79.08 86.33 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 120.989 0.424 . . . . 0.0 110.779 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -77.21 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.882 -177.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.21 -12.31 59.65 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.533 -174.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.58 ' HA2' HG12 ' A' ' 43' ' ' VAL . . . 76.91 -90.12 0.97 Allowed Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.479 -0.867 . . . . 0.0 111.464 -175.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.0 t70 . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.228 -0.892 . . . . 0.0 109.384 176.45 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -99.06 105.85 18.02 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 174.053 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.452 ' OE1' ' HD3' ' A' ' 18' ' ' LYS . 7.8 mm-40 -86.61 114.32 23.23 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.264 0.554 . . . . 0.0 111.41 -174.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.84 142.53 50.39 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.469 175.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.638 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -86.27 121.69 29.2 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.804 -178.065 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -151.51 -88.32 0.06 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.461 -0.791 . . . . 0.0 108.999 176.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.46 34.43 2.9 Favored Glycine 0 N--CA 1.451 -0.366 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.136 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.495 ' HD2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -128.13 10.54 6.38 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.831 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.634 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 4.0 t -115.0 -11.29 12.15 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 173.34 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.88 -6.06 20.53 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.191 -177.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.489 ' HG2' ' HA ' ' A' ' 8' ' ' ARG . 22.0 pt-20 -105.05 -14.56 15.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.988 -177.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.21 149.94 25.86 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.915 -176.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.445 ' CE2' ' HG2' ' A' ' 20' ' ' GLN . 2.6 t80 -56.94 109.12 0.59 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.11 0.481 . . . . 0.0 111.869 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.461 ' C ' ' H ' ' A' ' 16' ' ' ASP . 54.7 t30 -99.98 113.46 26.05 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 170.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.2 t -78.83 39.08 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.818 0.818 . . . . 0.0 110.509 -177.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.461 ' H ' ' C ' ' A' ' 14' ' ' ASN . 24.5 t0 -151.35 29.19 0.63 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.036 173.013 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.617 ' HB2' HE22 ' A' ' 20' ' ' GLN . 7.0 mmtp -110.09 155.06 22.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.468 175.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.452 ' HD3' ' OE1' ' A' ' 3' ' ' GLU . 0.0 OUTLIER -64.13 -74.09 0.11 Allowed 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.324 0.39 . . . . 0.0 111.032 178.846 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -102.4 154.97 18.57 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 174.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.617 HE22 ' HB2' ' A' ' 17' ' ' LYS . 1.1 tp-100 -138.62 146.71 42.05 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -171.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.634 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 39.8 m -140.56 117.69 11.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.21 -0.904 . . . . 0.0 108.866 168.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.534 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 10.7 t70 -154.76 179.4 9.12 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -69.38 -35.11 75.48 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 165.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 40.7 mt -74.93 2.29 10.73 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.393 178.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.534 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -63.72 -33.74 76.32 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 178.218 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -36.12 63.09 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.128 0.489 . . . . 0.0 110.488 176.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -62.76 -46.45 87.98 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.431 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -89.44 -8.74 52.37 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.338 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 52.91 47.22 25.15 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.201 0.524 . . . . 0.0 111.473 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.4 m -148.06 73.41 1.26 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.604 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -120.15 152.08 38.16 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.852 0.358 . . . . 0.0 110.883 177.216 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.489 ' SG ' ' SG ' ' A' ' 5' ' ' CYS . 1.6 m -76.34 159.06 30.88 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.101 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -25.87 67.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.012 0.434 . . . . 0.0 111.515 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.2 15.62 4.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.798 -177.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.447 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 23.3 t80 -65.79 -50.8 63.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.425 0.631 . . . . 0.0 110.162 -177.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.13 -29.5 62.94 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.048 -176.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.86 -49.91 59.47 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.212 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.638 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 31.1 mm-40 -84.35 -51.38 7.01 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.26 -0.427 . . . . 0.0 112.15 -174.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.09 -42.55 23.41 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.852 -175.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.18 56.32 14.1 Favored Pre-proline 0 N--CA 1.469 0.475 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 177.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -85.65 -15.76 4.89 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.22 1.946 . . . . 0.0 112.726 -178.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -105.41 100.55 10.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.035 0.445 . . . . 0.0 110.377 -177.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 t -76.18 109.77 10.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.431 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.19 94.3 2.94 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.371 -178.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -71.69 0.32 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.14 176.145 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 104.85 120.53 4.77 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.599 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 t70 . . . . . 0 C--O 1.246 0.909 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.132 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 34.0 p-10 . . . . . 0 N--CA 1.481 1.12 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -158.85 18.04 0.19 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.987 0.422 . . . . 0.0 110.868 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -74.85 83.99 2.18 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.282 -176.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m -73.86 132.54 42.63 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.621 176.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.598 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -71.09 149.52 46.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.635 -175.387 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -144.48 -104.42 0.11 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.138 173.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -89.72 37.5 3.34 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.961 -0.638 . . . . 0.0 113.438 -173.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.554 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -74.18 -26.39 60.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.003 0.43 . . . . 0.0 110.025 177.54 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.412 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 0.8 OUTLIER -72.71 -23.85 60.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.754 -174.676 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.64 -36.13 16.43 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.906 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -71.36 -43.33 67.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.274 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 119.65 175.03 15.76 Favored Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 111.364 -0.694 . . . . 0.0 111.364 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.425 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 4.2 t80 -76.02 107.63 8.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.166 0.508 . . . . 0.0 110.515 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -93.23 100.79 13.09 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.737 174.215 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.3 t -77.44 52.23 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.853 0.835 . . . . 0.0 110.457 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -151.67 -30.66 0.16 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.188 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.532 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -77.02 163.43 26.69 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.17 176.278 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -77.61 -62.9 1.51 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.245 -171.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.74 138.61 34.04 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.579 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.7 tp60 -130.86 142.91 50.41 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.703 -173.086 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.554 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 92.6 m -135.72 118.01 15.62 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 170.21 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.468 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 14.9 t70 -153.77 178.54 9.77 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 177.458 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.81 -25.87 63.98 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 166.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.446 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 0.3 OUTLIER -80.74 14.32 2.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.511 176.205 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.468 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -63.46 -47.52 81.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.551 -178.739 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.72 -25.61 66.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.224 0.535 . . . . 0.0 110.928 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.446 ' HB3' ' O ' ' A' ' 24' ' ' LEU . 78.0 t80 -63.29 -39.03 93.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.784 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -105.01 -16.44 14.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.414 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 58.1 38.78 26.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.284 0.564 . . . . 0.0 110.717 -177.372 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.4 m -127.57 41.47 3.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.761 -177.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.88 150.1 21.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.624 -179.538 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.0 m -73.24 154.11 40.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.333 177.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.87 -37.45 79.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.92 0.391 . . . . 0.0 111.773 -178.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.14 40.22 1.04 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.593 0.711 . . . . 0.0 110.889 -179.21 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.422 ' HD1' ' SG ' ' A' ' 21' ' ' CYS . 19.8 t80 -70.87 -42.78 69.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.688 178.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -31.8 72.97 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.354 -178.351 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.88 -43.56 79.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.804 -178.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.598 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 63.7 mm-40 -95.0 -37.59 11.06 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -173.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.9 t -82.38 -48.86 10.65 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.367 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 47.93 62.86 11.26 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.102 -177.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -74.72 6.71 3.11 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.694 2.263 . . . . 0.0 113.299 -171.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 64.44 79.49 0.25 Allowed 'General case' 0 C--O 1.235 0.334 0 O-C-N 123.468 0.48 . . . . 0.0 110.717 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 87.9 t -70.72 111.0 4.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.67 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.57 144.34 35.82 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.886 -174.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -119.83 133.01 55.74 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 173.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -59.42 -60.55 8.59 Favored Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.003 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.8 t70 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.434 -0.793 . . . . 0.0 109.95 176.938 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 121.371 0.605 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -148.01 23.68 1.07 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.611 -178.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.455 ' HA ' ' CB ' ' A' ' 19' ' ' CYS . 0.9 OUTLIER -97.09 47.52 1.04 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.968 -176.312 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -141.2 141.54 34.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.23 177.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.523 ' HA ' ' HG3' ' A' ' 8' ' ' ARG . 30.3 m -100.29 131.85 45.99 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.439 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.13 -68.63 0.87 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.13 0.49 . . . . 0.0 109.839 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -115.32 29.89 7.05 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 178.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.523 ' HG3' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -96.66 61.3 1.89 Allowed 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 -176.204 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -166.92 45.25 0.06 Allowed 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.34 -1.3 . . . . 0.0 109.323 171.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -163.86 -37.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.205 -175.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -77.63 -31.06 52.57 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.783 -176.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 115.41 162.02 13.32 Favored Glycine 0 N--CA 1.439 -1.131 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -170.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -59.25 114.37 2.6 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 117.145 0.472 . . . . 0.0 111.389 -175.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -77.88 85.86 4.12 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.734 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.407 HG23 ' H ' ' A' ' 15' ' ' VAL . 0.0 OUTLIER -71.73 -6.45 7.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 121.263 0.554 . . . . 0.0 109.627 179.742 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.13 -32.48 50.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.82 174.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.531 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -72.3 172.71 9.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.411 0.624 . . . . 0.0 112.094 -168.452 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.49 -51.28 5.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.307 -179.037 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.455 ' CB ' ' HA ' ' A' ' 3' ' ' GLU . 4.6 t -103.63 138.4 40.34 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 169.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.717 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.8 mm-40 -118.98 132.44 56.07 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.469 0.652 . . . . 0.0 112.652 -167.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.413 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -138.59 119.49 14.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.625 169.235 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.439 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 5.9 t70 -156.64 -168.78 2.79 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 165.031 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.19 -29.31 70.68 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.736 0.779 . . . . 0.0 108.952 169.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.435 HD23 ' CD2' ' A' ' 27' ' ' TYR . 0.4 OUTLIER -89.07 14.66 10.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.667 -178.148 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.439 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -62.22 -37.99 87.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.623 0.249 . . . . 0.0 110.862 -178.61 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.85 -26.7 63.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.934 0.397 . . . . 0.0 111.011 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.435 ' CD2' HD23 ' A' ' 24' ' ' LEU . 58.5 t80 -67.42 -36.32 81.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.943 -178.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -100.72 -15.69 17.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.91 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 53.53 58.54 5.08 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.075 -178.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.7 m -148.77 48.42 1.01 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.472 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.717 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.63 138.08 34.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.908 0.385 . . . . 0.0 111.397 -176.987 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.13 162.23 28.69 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.837 177.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -27.22 68.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.257 0.551 . . . . 0.0 111.018 177.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.87 -10.29 59.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.37 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.451 ' CE2' ' HG3' ' A' ' 41' ' ' PRO . 31.7 t80 -67.33 -46.66 72.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.361 0.601 . . . . 0.0 110.048 -176.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.61 -29.35 62.32 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.64 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.87 -50.42 42.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.429 178.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.411 ' OE1' ' HA ' ' A' ' 38' ' ' GLU . 4.9 mm-40 -88.71 -43.26 11.43 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -173.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.0 t -84.33 -42.96 15.24 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.592 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.93 65.36 3.35 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.251 178.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.451 ' HG3' ' CE2' ' A' ' 35' ' ' TYR . 87.8 Cg_endo -77.82 -18.77 13.06 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.375 2.05 . . . . 0.0 111.017 175.586 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -135.03 110.61 9.17 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.047 -0.979 . . . . 0.0 109.601 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.2 t -85.93 149.24 4.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.55 176.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.05 130.73 45.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.475 178.104 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -81.34 162.05 23.58 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.693 0.282 . . . . 0.0 110.286 -178.054 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -136.06 145.97 17.94 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.415 -177.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.2 t70 . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.326 -0.845 . . . . 0.0 110.311 -178.383 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.455 ' O ' ' HB3' ' A' ' 2' ' ' GLN . 9.8 t70 . . . . . 0 N--CA 1.479 1.017 0 CA-C-O 120.803 0.335 . . . . 0.0 110.477 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.492 ' HG2' ' HG3' ' A' ' 3' ' ' GLU . 0.2 OUTLIER 170.74 -31.23 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.237 -0.892 . . . . 0.0 108.75 179.341 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.755 ' HA ' ' HB2' ' A' ' 19' ' ' CYS . 0.9 OUTLIER -100.07 41.53 1.16 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.065 -0.97 . . . . 0.0 108.697 173.972 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -128.99 123.12 31.6 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.62 -178.087 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -85.44 138.33 32.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.794 -176.65 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -125.9 -52.1 1.56 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 173.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -166.22 43.26 0.27 Allowed Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.662 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.424 ' HD2' ' SG ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -95.44 12.42 29.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.412 0.625 . . . . 0.0 109.99 177.925 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -79.89 -2.59 44.3 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.433 179.624 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.94 -1.78 18.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.346 -178.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -98.49 -8.78 26.07 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.719 0.295 . . . . 0.0 110.743 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.68 162.32 35.96 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.138 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.579 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 4.5 t80 -74.77 106.87 6.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.278 0.561 . . . . 0.0 110.438 177.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.479 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -99.85 102.27 13.64 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.099 174.523 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.576 HG13 ' HE1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -78.54 41.13 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.12 0.486 . . . . 0.0 110.758 -175.569 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -166.69 24.32 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.033 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.479 ' HG2' ' HB3' ' A' ' 14' ' ' ASN . 9.0 mmtm -89.3 -103.44 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.175 0.512 . . . . 0.0 110.228 176.274 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.432 ' HG3' ' C ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -150.48 -56.06 0.16 Allowed 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.161 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.755 ' HB2' ' HA ' ' A' ' 3' ' ' GLU . 1.8 t -124.84 147.76 48.58 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.465 171.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.637 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 2.7 mp0 -125.32 131.66 53.0 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.898 0.38 . . . . 0.0 111.679 -171.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.46 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 11.4 m -137.88 118.98 14.42 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 170.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -152.1 -170.62 3.69 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -69.05 -30.92 69.36 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 167.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mt -85.66 14.99 5.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.843 -178.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.578 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -63.55 -39.49 94.54 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 178.401 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.99 -28.52 62.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.833 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -65.49 -47.37 76.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.708 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -89.33 -11.97 41.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.008 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 53.81 43.78 30.49 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.175 0.512 . . . . 0.0 110.516 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 m -139.55 58.59 1.61 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.874 -176.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.637 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -110.48 156.0 21.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.329 177.096 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.6 m -72.48 156.2 39.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.491 177.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -22.34 66.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.988 -177.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.46 21.48 12.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.107 -177.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.483 ' O ' ' HB2' ' A' ' 39' ' ' CYS . 20.8 t80 -60.82 -50.96 71.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.119 0.485 . . . . 0.0 110.683 -177.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.471 ' O ' ' HE2' ' A' ' 40' ' ' LYS . 0.8 OUTLIER -72.98 -30.27 63.68 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.381 -177.383 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.72 -46.33 66.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.655 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 71.6 mm-40 -95.86 -39.99 9.54 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -173.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 96.0 m -82.43 -44.45 16.05 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.808 -178.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.471 ' HE2' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 59.32 78.0 0.36 Allowed Pre-proline 0 CA--C 1.531 0.221 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.147 179.851 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -63.31 -21.38 71.74 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.829 2.353 . . . . 0.0 112.589 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 56.53 48.38 16.8 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.09 177.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 p -99.51 123.69 52.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.262 0.553 . . . . 0.0 110.89 -178.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.43 -157.57 0.16 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.422 177.609 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -140.65 113.67 8.39 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 121.84 -0.538 . . . . 0.0 111.763 -178.387 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -92.41 104.65 3.2 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 110.934 -0.866 . . . . 0.0 110.934 172.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.1 t70 . . . . . 0 C--O 1.251 1.144 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.378 -177.682 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.714 0.292 . . . . 0.0 110.758 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.86 23.41 8.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.341 0.591 . . . . 0.0 110.053 179.054 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -96.54 2.95 52.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.978 -177.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.85 118.2 28.39 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.315 -179.22 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.559 ' H ' ' HB2' ' A' ' 34' ' ' ASP . 3.1 t -85.48 143.24 28.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.537 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.34 -89.83 0.51 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.851 0.358 . . . . 0.0 110.064 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.98 47.12 1.04 Allowed Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.711 -0.757 . . . . 0.0 111.646 178.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.468 ' HB2' ' NH1' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.27 8.23 36.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.112 0.482 . . . . 0.0 110.341 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.3 -15.04 48.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.35 0.595 . . . . 0.0 109.96 177.568 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.36 -10.12 59.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.177 -178.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -102.15 -5.89 23.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.546 178.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 79.15 -177.56 54.16 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.266 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -72.11 108.55 5.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.02 0.438 . . . . 0.0 110.798 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.42 ' C ' ' H ' ' A' ' 16' ' ' ASP . 2.0 t30 -99.14 105.57 17.66 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.583 172.129 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.405 HG23 ' H ' ' A' ' 15' ' ' VAL . 0.2 OUTLIER -78.8 41.28 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.667 0.746 . . . . 0.0 110.157 -179.127 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.42 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -128.35 -20.87 3.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.056 -0.974 . . . . 0.0 110.128 178.391 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 29.8 mmtm -91.31 -175.02 4.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.218 0.532 . . . . 0.0 111.495 -173.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.524 ' H ' ' HD2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -87.5 -69.52 0.68 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.248 -177.624 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.27 139.19 35.29 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 174.266 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.581 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -126.32 148.84 49.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.815 0.34 . . . . 0.0 110.886 -175.813 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 69.1 m -133.8 116.59 15.88 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 171.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.419 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 14.4 t70 -154.12 178.0 10.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.182 176.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.96 -27.21 64.55 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 168.753 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.404 ' N ' ' HG3' ' A' ' 23' ' ' GLU . 54.1 mt -82.46 14.7 2.88 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.406 178.034 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -58.63 -40.68 84.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.702 0.287 . . . . 0.0 110.743 -179.584 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -25.9 59.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.032 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -64.83 -49.4 70.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.584 -178.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -88.68 -15.92 33.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.844 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.69 48.85 5.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.308 -176.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 44.0 m -149.13 73.21 1.2 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.763 -178.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -114.42 149.01 36.86 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.021 177.004 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -75.63 152.76 37.57 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 175.934 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.85 -33.52 74.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -174.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.559 ' HB2' ' H ' ' A' ' 5' ' ' CYS . 0.8 OUTLIER -86.58 24.52 1.41 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.593 -176.568 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.482 ' O ' ' HB2' ' A' ' 39' ' ' CYS . 19.5 t80 -67.27 -50.72 59.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.231 0.539 . . . . 0.0 110.455 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.508 ' O ' ' HE3' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -73.65 -30.59 63.02 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.347 -175.783 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.69 -53.52 18.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.505 -178.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -90.76 -37.76 13.46 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -172.016 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 73.6 m -82.08 -55.93 4.26 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.179 -176.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.508 ' HE3' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 60.64 79.81 0.28 Allowed Pre-proline 0 N--CA 1.463 0.203 0 O-C-N 123.427 0.454 . . . . 0.0 110.904 179.609 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.425 ' HB2' HG23 ' A' ' 43' ' ' VAL . 40.7 Cg_endo -67.89 -5.38 14.37 Favored 'Trans proline' 0 CA--C 1.532 0.386 0 C-N-CA 123.119 2.546 . . . . 0.0 113.333 -176.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 59.59 32.17 21.41 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.008 0.433 . . . . 0.0 111.413 178.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.425 HG23 ' HB2' ' A' ' 41' ' ' PRO . 83.6 t -99.67 106.16 18.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.078 0.466 . . . . 0.0 110.307 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.01 -5.0 55.97 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.267 177.583 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.8 tpm_? 71.97 -59.32 0.56 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.3 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 97.72 29.6 7.66 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.804 -0.712 . . . . 0.0 111.424 -177.156 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.1 t70 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.62 -0.705 . . . . 0.0 110.225 -179.158 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 . . . . . 0 N--CA 1.482 1.152 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -151.46 53.06 0.84 Allowed 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 121.385 0.612 . . . . 0.0 111.065 -178.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -92.54 -4.57 53.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.503 0.668 . . . . 0.0 110.193 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.86 132.69 35.75 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.858 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.575 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 1.6 t -87.91 142.82 27.5 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.834 0.35 . . . . 0.0 110.742 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.44 ' HA ' ' HG3' ' A' ' 38' ' ' GLU . 14.4 mmtt -134.58 -79.42 0.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.722 175.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -132.82 59.85 0.68 Allowed Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.025 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.564 ' NH2' ' HB3' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -128.44 28.76 5.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.054 0.454 . . . . 0.0 110.218 178.413 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.1 OUTLIER -110.46 -11.51 14.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.283 177.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.32 -12.48 40.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.506 -177.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -96.91 -18.37 19.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.724 -177.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 118.94 -176.55 16.12 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.473 -177.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.676 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 9.4 t80 -81.73 108.34 15.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.881 0.372 . . . . 0.0 110.62 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -79.14 94.16 5.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.013 174.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.496 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -86.11 36.03 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-O 121.286 0.565 . . . . 0.0 110.519 -177.972 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -138.06 -13.23 1.42 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.823 -176.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.439 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 1.0 OUTLIER -92.84 -172.27 2.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.229 0.538 . . . . 0.0 111.963 -170.554 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.21 -17.3 46.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.258 -179.166 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.564 ' HB3' ' NH2' ' A' ' 8' ' ' ARG . 5.6 t -162.81 142.12 8.94 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.091 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.582 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -127.44 150.97 49.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.78 0.324 . . . . 0.0 111.311 -171.281 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.511 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 86.9 m -142.1 117.73 10.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.271 173.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.463 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 17.5 t70 -153.81 -177.77 6.61 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 171.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -68.61 -28.97 67.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 167.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mt -77.39 12.12 1.68 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.508 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.676 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -57.34 -42.57 82.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.074 179.51 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.44 -27.16 60.48 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.916 0.389 . . . . 0.0 111.084 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -67.41 -44.26 79.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.404 -178.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -90.72 -16.06 29.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.932 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 56.9 54.34 7.21 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.138 -174.102 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.2 m -154.34 76.64 1.04 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.156 -178.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.582 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -125.16 148.48 48.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.505 176.789 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.575 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 5.4 m -70.89 154.37 41.88 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.555 175.148 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.99 -28.74 69.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.617 -178.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.74 21.56 4.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.045 -178.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -65.36 -47.33 76.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.762 0.792 . . . . 0.0 109.285 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.446 ' O ' ' HE2' ' A' ' 40' ' ' LYS . 0.5 OUTLIER -74.06 -29.71 62.03 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.014 -179.755 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.71 -40.6 76.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.853 -177.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.44 ' HG3' ' HA ' ' A' ' 6' ' ' LYS . 64.8 mm-40 -98.38 -51.01 4.11 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -175.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 4.3 m -73.52 -34.68 65.38 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -177.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.446 ' HE2' ' O ' ' A' ' 36' ' ' THR . 0.2 OUTLIER 52.04 75.54 0.64 Allowed Pre-proline 0 N--CA 1.465 0.287 0 O-C-N 123.66 0.6 . . . . 0.0 112.232 173.892 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.508 ' O ' ' HB2' ' A' ' 42' ' ' GLN . 60.8 Cg_endo -79.17 38.39 0.72 Allowed 'Trans proline' 0 CA--C 1.529 0.264 0 C-N-CA 123.327 2.685 . . . . 0.0 111.748 176.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 20.1 mt-30 79.56 -44.06 0.3 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.099 0.96 . . . . 0.0 110.796 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.441 ' HB ' ' O ' ' A' ' 42' ' ' GLN . 82.0 t 77.65 121.42 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 O-C-N 124.189 0.931 . . . . 0.0 111.149 176.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.25 117.35 8.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.291 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -91.92 58.78 3.48 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.353 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -144.22 39.88 1.21 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.068 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.4 t70 . . . . . 0 C--O 1.252 1.211 0 CA-C-O 118.554 -0.736 . . . . 0.0 109.987 179.647 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 3.8 t0 . . . . . 0 N--CA 1.483 1.188 0 CA-C-O 121.144 0.497 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -103.97 90.69 3.68 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 176.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.578 ' HG3' ' HB2' ' A' ' 19' ' ' CYS . 0.4 OUTLIER -81.92 -179.4 7.38 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.904 179.394 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.7 m -120.78 140.18 52.06 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.78 -179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.636 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -78.55 127.64 32.43 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.094 178.539 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.453 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -98.71 -88.08 0.33 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.324 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.32 49.33 0.92 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 120.678 -0.772 . . . . 0.0 111.979 177.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.636 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 4.8 mmt85 -76.05 -6.83 52.9 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.826 0.346 . . . . 0.0 110.782 -175.403 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.413 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 23.7 m -79.53 -7.4 58.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.226 -176.219 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.54 -36.58 10.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.649 0.262 . . . . 0.0 111.062 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.39 -46.97 29.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.988 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 124.02 -178.69 16.37 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.013 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.665 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 4.0 t80 -79.53 108.5 13.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.879 0.371 . . . . 0.0 111.559 -178.134 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -94.44 105.09 17.05 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 168.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 t -64.41 -21.52 29.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.264 0.554 . . . . 0.0 109.916 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -94.54 41.04 1.09 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.074 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.472 ' HD2' ' HA ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -119.27 165.55 14.12 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 170.271 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.549 ' HG3' ' OE1' ' A' ' 3' ' ' GLU . 0.0 OUTLIER -87.64 -19.51 27.62 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.336 0.589 . . . . 0.0 110.143 -176.119 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.578 ' HB2' ' HG3' ' A' ' 3' ' ' GLU . 2.7 t -146.55 139.47 25.41 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 175.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.617 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -130.15 142.39 50.59 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -171.053 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.455 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 66.1 m -138.18 117.32 12.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.546 167.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.458 ' H ' ' HB3' ' A' ' 25' ' ' CYS . 35.7 t0 -154.9 179.97 8.61 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 175.237 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -15.53 63.42 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 166.26 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.8 mt -89.9 0.25 57.17 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.376 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.665 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -66.27 -25.58 66.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.735 0.303 . . . . 0.0 110.802 -176.337 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -39.82 62.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.896 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -63.35 -40.37 97.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.972 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -88.44 -15.44 35.44 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.321 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 54.64 45.28 27.15 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.53 -177.645 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.27 70.19 1.22 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.185 -178.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.617 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -109.61 148.61 31.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.118 176.154 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 21.1 m -65.29 157.77 28.16 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.931 0.396 . . . . 0.0 111.496 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.38 -26.18 63.6 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.277 0.56 . . . . 0.0 110.85 178.613 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.61 15.86 13.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.254 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.594 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 16.2 t80 -71.23 -39.46 71.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.699 -178.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -35.27 65.86 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.981 -179.305 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.07 -48.28 58.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.931 -178.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -90.81 -42.87 10.41 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -174.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.594 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 35.9 t -82.42 -51.94 7.36 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.379 -175.342 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.405 ' HE3' ' HB2' ' A' ' 40' ' ' LYS . 0.4 OUTLIER 57.72 75.56 0.54 Allowed Pre-proline 0 CA--C 1.531 0.242 0 O-C-N 123.607 0.567 . . . . 0.0 111.151 176.719 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -50.37 -49.44 16.48 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.089 2.526 . . . . 0.0 112.65 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 71.53 -12.01 0.67 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.288 0.635 . . . . 0.0 112.577 175.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -63.2 121.2 11.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.739 0.304 . . . . 0.0 110.519 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -119.52 138.89 52.88 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.403 178.726 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.3 ttm180 -150.05 113.51 4.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.795 0.331 . . . . 0.0 110.484 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -140.28 -116.44 1.32 Allowed Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.617 177.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.4 t70 . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.256 -0.878 . . . . 0.0 109.363 179.229 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.086 0 CA-C-O 120.925 0.393 . . . . 0.0 111.138 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.46 21.04 0.41 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.909 176.45 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.406 ' HG2' ' H ' ' A' ' 3' ' ' GLU . 1.3 pm0 -86.19 50.08 1.92 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.145 -177.011 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -136.93 152.01 49.7 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.884 176.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 2.6 t -80.33 138.18 36.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.801 0.334 . . . . 0.0 110.262 -178.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -134.28 -81.79 0.45 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.104 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -112.09 31.93 6.66 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 176.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.67 ' O ' ' HB2' ' A' ' 21' ' ' CYS . 2.9 mtt-85 -86.51 54.07 3.03 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 121.586 0.708 . . . . 0.0 109.87 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -150.64 18.64 0.81 Allowed 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 167.28 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.69 -36.65 0.21 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.924 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.525 ' HG2' ' HA ' ' A' ' 8' ' ' ARG . 17.2 pt-20 -68.6 -25.07 64.68 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.079 178.107 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 102.7 161.23 25.87 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.246 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.543 ' CE1' ' HG3' ' A' ' 20' ' ' GLN . 3.9 t80 -68.4 119.27 12.63 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.269 0.557 . . . . 0.0 110.607 178.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.548 ' HB3' ' HB2' ' A' ' 17' ' ' LYS . 4.2 t-20 -103.34 104.15 14.23 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.895 175.146 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -79.47 51.47 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 176.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -157.52 -41.99 0.07 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.671 -1.15 . . . . 0.0 109.475 -174.327 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.548 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -67.18 126.48 29.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.009 174.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.42 -59.26 1.63 Allowed 'General case' 0 N--CA 1.474 0.767 0 O-C-N 124.014 0.821 . . . . 0.0 113.172 -175.562 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -100.12 143.84 29.86 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 177.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.647 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.4 mm-40 -131.34 145.17 51.73 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.127 0.489 . . . . 0.0 112.108 -173.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.819 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 1.8 m -136.4 120.22 17.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.441 171.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.429 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 10.4 t70 -154.87 -171.49 3.85 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 172.542 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.04 -33.03 72.95 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 107.248 -1.389 . . . . 0.0 107.248 162.491 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.9 mp -77.85 14.39 1.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.557 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.429 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -65.59 -37.36 86.4 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 176.959 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -26.31 62.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.167 0.508 . . . . 0.0 110.582 176.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.403 ' HD2' ' CD2' ' A' ' 28' ' ' TYR . 91.7 t80 -66.34 -39.77 89.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.093 -178.19 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.403 ' CD2' ' HD2' ' A' ' 27' ' ' TYR . 43.6 m-85 -102.87 -8.68 20.54 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.657 0.265 . . . . 0.0 110.709 177.395 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 50.68 48.7 22.27 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.771 -177.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.6 m -140.22 54.34 1.63 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.51 -177.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.647 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.95 137.09 36.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.43 -178.316 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.23 151.77 43.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.943 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.9 -27.61 66.87 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -174.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.06 13.4 18.95 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.194 -176.387 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.819 ' CD1' ' HB3' ' A' ' 21' ' ' CYS . 3.3 t80 -63.86 -48.45 76.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.2 -178.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.07 -31.21 68.69 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.298 -177.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.58 -51.53 27.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.359 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -77.58 -49.52 14.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.983 -174.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 1.4 t -85.27 -54.49 4.57 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.85 -175.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 61.28 78.19 0.32 Allowed Pre-proline 0 C--O 1.233 0.225 0 O-C-N 123.49 0.494 . . . . 0.0 110.861 -177.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.24 -15.96 47.3 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.783 2.322 . . . . 0.0 112.313 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 72.5 142.42 0.06 Allowed 'General case' 0 C--O 1.233 0.195 0 O-C-N 124.01 0.819 . . . . 0.0 112.355 177.588 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -135.16 -172.22 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.008 176.39 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 m 60.07 63.45 1.43 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.415 0.626 . . . . 0.0 110.554 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.45 147.02 50.64 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.224 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 138.26 157.06 7.32 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.699 177.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.3 t70 . . . . . 0 C--O 1.246 0.905 0 CA-C-O 119.022 -0.513 . . . . 0.0 109.813 177.359 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 120.946 0.403 . . . . 0.0 110.48 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.564 ' O ' ' HB2' ' A' ' 3' ' ' GLU . 0.0 OUTLIER -82.84 163.08 21.41 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 178.568 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.564 ' HB2' ' O ' ' A' ' 2' ' ' GLN . 0.1 OUTLIER 80.42 129.67 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 O-C-N 124.27 0.981 . . . . 0.0 110.179 -176.004 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.68 171.37 14.45 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.059 -0.518 . . . . 0.0 109.632 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.557 ' HB2' ' HB2' ' A' ' 38' ' ' GLU . 87.0 m -65.74 153.45 41.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.432 0.634 . . . . 0.0 111.156 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.518 ' O ' ' HE3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -151.71 31.08 0.57 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.468 0.651 . . . . 0.0 109.397 175.995 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 80.58 33.4 31.14 Favored Glycine 0 N--CA 1.443 -0.84 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.806 -174.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -4.99 44.23 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.96 0.41 . . . . 0.0 110.288 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.598 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 35.3 m -68.7 1.74 3.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.162 177.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 p -86.26 -24.23 26.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.148 0.499 . . . . 0.0 110.319 176.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -98.76 -6.22 29.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.274 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.91 -166.76 34.13 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.316 -176.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.446 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 15.7 t80 -70.55 108.11 4.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.944 0.402 . . . . 0.0 110.822 178.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.439 HD21 ' HA ' ' A' ' 20' ' ' GLN . 0.5 OUTLIER -78.23 86.29 4.35 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.416 176.994 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.8 56.54 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.811 0.815 . . . . 0.0 109.571 177.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -155.01 -41.35 0.09 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.761 -1.109 . . . . 0.0 109.242 -176.283 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.549 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -76.17 173.02 11.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.846 -179.392 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.43 ' HB2' ' HE3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -85.59 -36.78 20.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.661 -174.718 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -111.5 138.73 47.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.688 174.718 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.536 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 18.9 mp0 -123.83 138.17 54.54 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.919 0.39 . . . . 0.0 111.195 -175.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.598 ' HB2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -139.7 117.35 11.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.138 0.494 . . . . 0.0 109.751 167.822 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.411 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 25.6 t0 -154.23 -176.57 5.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.086 -0.961 . . . . 0.0 108.691 175.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.52 -33.22 73.74 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 166.632 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.0 mt -75.51 14.43 0.61 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.799 178.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.436 ' HB2' ' HB3' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -61.57 -38.13 86.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.785 0.326 . . . . 0.0 110.194 -179.539 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.77 -26.52 59.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.113 178.31 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -64.94 -40.83 95.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.726 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -98.32 -13.35 20.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.651 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 55.56 48.88 17.76 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.477 0.656 . . . . 0.0 110.076 -174.137 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.427 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 27.3 m -149.3 76.85 1.34 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.945 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.536 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -120.74 150.96 40.16 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.931 176.617 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 3.5 m -70.81 144.25 50.87 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -29.55 69.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.895 0.378 . . . . 0.0 111.296 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -91.0 31.29 1.1 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.194 0.521 . . . . 0.0 110.957 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.4 ' HD1' ' HB3' ' A' ' 21' ' ' CYS . 17.8 t80 -65.52 -40.58 93.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.647 0.737 . . . . 0.0 109.652 179.204 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.446 ' HA ' ' HD2' ' A' ' 41' ' ' PRO . 0.1 OUTLIER -72.05 -34.08 68.49 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.726 179.73 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -71.12 -55.06 8.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.198 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.557 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 32.7 mt-10 -97.51 0.43 47.51 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -169.331 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -126.6 -36.74 2.22 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.444 173.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.24 74.87 0.51 Allowed Pre-proline 0 N--CA 1.465 0.29 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 171.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.446 ' HD2' ' HA ' ' A' ' 36' ' ' THR . 17.8 Cg_endo -61.06 -62.88 0.12 Allowed 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.275 1.984 . . . . 0.0 111.831 177.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -172.73 139.84 0.94 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.939 177.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.5 t -127.62 120.38 54.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 174.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -119.52 -161.32 0.85 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.296 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.94 -39.73 10.05 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 178.463 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 133.81 85.42 0.25 Allowed Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.079 178.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.1 t0 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.925 -0.559 . . . . 0.0 109.535 179.668 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 5.2 t0 . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -97.13 100.44 11.92 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.514 ' H ' ' HB3' ' A' ' 19' ' ' CYS . 0.6 OUTLIER -82.72 -172.52 4.13 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.77 -178.931 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -97.09 136.91 36.96 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.927 179.054 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.517 ' H ' ' HB2' ' A' ' 34' ' ' ASP . 0.9 OUTLIER -84.39 154.13 23.02 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.629 -178.315 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.528 ' HG3' ' N ' ' A' ' 7' ' ' GLY . 0.0 OUTLIER -164.01 -33.77 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.91 177.388 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.528 ' N ' ' HG3' ' A' ' 6' ' ' LYS . . . -154.47 63.35 0.35 Allowed Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.211 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.403 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -129.41 -37.34 1.63 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 175.623 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.4 -21.2 65.6 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.748 -178.042 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -85.69 -13.03 49.74 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.355 -176.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -111.16 -54.7 2.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.657 -177.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.99 -171.14 26.25 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.695 -0.765 . . . . 0.0 111.853 -179.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.705 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 3.2 t80 -83.61 112.48 20.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.921 0.391 . . . . 0.0 111.137 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.415 ' C ' ' H ' ' A' ' 16' ' ' ASP . 1.5 t30 -99.57 103.0 14.68 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 171.304 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.401 ' H ' HG23 ' A' ' 15' ' ' VAL . 0.2 OUTLIER -78.53 42.67 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.512 0.673 . . . . 0.0 109.962 -177.812 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -128.8 -27.66 2.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.405 -178.555 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.513 ' HB2' ' OE1' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -87.15 -165.58 1.34 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.786 -177.37 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.46 -61.88 1.47 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.186 -178.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.514 ' HB3' ' H ' ' A' ' 3' ' ' GLU . 1.0 OUTLIER -110.22 138.88 46.0 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.273 0.558 . . . . 0.0 109.86 176.821 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.643 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 4.2 mp0 -120.32 152.42 37.85 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.622 -177.05 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.471 ' HB3' ' CD2' ' A' ' 35' ' ' TYR . 86.2 m -123.12 113.44 18.98 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 168.167 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.497 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 13.1 t70 -156.66 179.04 9.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.995 178.564 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.46 -35.53 75.72 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 165.555 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.1 mt -77.11 9.38 3.07 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.654 -179.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.705 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -60.86 -41.74 96.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.169 -175.963 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.66 -29.89 63.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.247 -177.003 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -62.85 -48.92 76.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.782 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -84.0 -15.16 48.69 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.226 177.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.82 45.35 15.57 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.611 -178.01 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -138.17 63.03 1.55 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.465 -178.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.643 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -102.77 153.28 20.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.875 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.46 ' HB3' ' O ' ' A' ' 3' ' ' GLU . 1.9 m -82.16 139.08 34.54 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 171.5 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -21.91 65.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.278 0.561 . . . . 0.0 111.474 -177.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.517 ' HB2' ' H ' ' A' ' 5' ' ' CYS . 0.7 OUTLIER -86.04 17.85 3.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.237 -175.345 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.471 ' CD2' ' HB3' ' A' ' 21' ' ' CYS . 15.0 t80 -64.53 -55.57 19.7 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.369 0.605 . . . . 0.0 110.409 -178.309 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.2 p -70.62 -29.03 65.3 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.254 -175.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -68.47 -55.08 13.01 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.892 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -91.36 -50.98 5.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.3 m -71.53 -47.27 56.27 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 121.225 -0.19 . . . . 0.0 111.055 -173.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 mtpp 59.36 77.5 0.39 Allowed Pre-proline 0 N--CA 1.464 0.231 0 O-C-N 123.409 0.443 . . . . 0.0 110.569 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -56.66 -64.05 0.15 Allowed 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 123.313 2.675 . . . . 0.0 112.573 -175.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -155.91 121.36 4.87 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.633 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.1 t -95.1 85.08 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 174.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -64.63 105.58 1.0 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.521 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -79.65 104.79 10.48 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 176.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.49 46.83 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 -177.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.482 -0.77 . . . . 0.0 110.48 -177.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.281 0 CA-C-O 120.487 0.184 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -153.88 161.03 42.35 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 177.106 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.61 34.39 23.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.572 0.701 . . . . 0.0 110.27 -175.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.552 ' HA ' ' HB2' ' A' ' 34' ' ' ASP . 0.8 OUTLIER -64.55 133.83 53.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.857 -178.574 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.473 ' HB3' ' HG3' ' A' ' 8' ' ' ARG . 2.8 m -77.97 119.7 21.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.904 177.356 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 mtmt -119.76 -54.77 2.13 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 176.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.88 -17.85 42.62 Favored Glycine 0 N--CA 1.44 -1.079 0 CA-C-N 115.276 -0.875 . . . . 0.0 112.349 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.473 ' HG3' ' HB3' ' A' ' 5' ' ' CYS . 0.1 OUTLIER -98.62 40.85 1.17 Allowed 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 122.025 -0.691 . . . . 0.0 110.501 -173.456 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.636 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.8 OUTLIER -131.44 -7.29 3.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.455 177.007 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.39 2.47 8.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.72 -174.573 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -104.68 12.21 33.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.225 0.536 . . . . 0.0 110.389 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 86.75 -173.29 45.2 Favored Glycine 0 N--CA 1.442 -0.953 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.601 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 7.9 t80 -93.73 107.13 19.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.691 0.282 . . . . 0.0 110.439 -178.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.36 95.25 8.68 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.851 173.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.452 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -80.78 41.32 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.522 0.677 . . . . 0.0 110.115 -178.314 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -134.31 -13.26 2.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.051 -178.335 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 13.9 mmtm -91.85 179.3 5.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.143 0.497 . . . . 0.0 111.904 -170.302 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.92 -29.88 28.86 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.622 -178.394 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -140.01 149.45 43.23 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.601 ' HG2' ' CE1' ' A' ' 13' ' ' PHE . 13.4 mp0 -130.73 146.09 52.11 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.999 -174.265 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.636 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 4.1 m -143.88 117.79 9.38 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 169.781 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.591 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 17.6 t70 -154.64 -179.35 7.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -69.12 -29.48 67.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 166.256 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 50.5 mt -79.56 14.42 1.65 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.167 176.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.591 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -63.28 -39.32 94.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.706 -0.225 . . . . 0.0 110.548 -179.867 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.95 -28.27 61.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.131 -179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -64.15 -52.32 59.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.664 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -85.18 -16.17 41.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.927 -179.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.0 44.64 22.52 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.98 -179.326 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.6 m -141.77 56.74 1.5 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.192 -177.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.549 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.1 OUTLIER -108.76 146.03 34.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.663 179.131 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 m -69.55 156.88 38.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.891 179.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -28.57 69.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.968 0.413 . . . . 0.0 111.989 -177.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.552 ' HB2' ' HA ' ' A' ' 4' ' ' SER . 2.5 m-20 -85.25 13.97 5.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.293 -175.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.46 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 46.3 t80 -66.72 -50.5 62.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.094 0.473 . . . . 0.0 110.637 -177.709 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.477 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -70.63 -28.61 64.95 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.104 -178.224 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.52 -52.75 50.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.969 178.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -89.63 -53.74 4.39 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -71.01 -44.37 66.01 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.696 -172.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' A' ' 36' ' ' THR . 0.2 OUTLIER 58.07 85.1 0.19 Allowed Pre-proline 0 N--CA 1.465 0.323 0 O-C-N 123.712 0.632 . . . . 0.0 112.088 176.861 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -75.98 -16.79 17.91 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.474 2.116 . . . . 0.0 111.501 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 61.81 86.69 0.11 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 115.234 -0.894 . . . . 0.0 111.153 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -86.76 153.05 3.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.001 -178.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.6 m -121.97 -6.54 8.98 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.91 -177.463 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 68.12 11.73 8.48 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.335 178.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.35 -125.45 7.15 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.141 -178.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.6 t70 . . . . . 0 C--O 1.244 0.802 0 CA-C-O 118.463 -0.78 . . . . 0.0 109.952 -179.33 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.58 132.53 42.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.853 0.359 . . . . 0.0 110.474 177.734 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.16 87.87 4.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.893 -177.376 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 74.0 m -77.98 146.7 35.28 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.258 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.635 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 44.4 t -83.05 149.87 26.67 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.358 -178.288 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -162.48 -64.26 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 123.555 0.535 . . . . 0.0 110.179 173.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.81 34.16 4.8 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.422 -173.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.477 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 2.2 mmp_? -98.97 -32.95 11.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.419 0.61 . . . . 0.0 110.149 175.032 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.465 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 1.0 OUTLIER -68.55 -21.69 64.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.416 -175.021 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.58 -27.52 45.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.265 -177.373 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.95 -50.31 4.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.891 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 135.77 -156.97 23.09 Favored Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 111.296 -0.722 . . . . 0.0 111.296 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.57 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 3.9 t80 -84.29 107.83 16.8 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.132 0.491 . . . . 0.0 110.915 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.415 ' C ' ' H ' ' A' ' 16' ' ' ASP . 0.2 OUTLIER -89.63 93.04 9.32 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.589 173.507 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.419 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -78.47 35.97 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.131 0.491 . . . . 0.0 110.885 -176.634 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.2 OUTLIER -133.37 2.3 3.53 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.114 177.569 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.5 mmpp? -109.08 -169.52 1.5 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.311 -178.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.17 -63.79 1.11 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.452 -178.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.08 138.57 35.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.941 177.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.57 ' HG2' ' CE1' ' A' ' 13' ' ' PHE . 2.3 mp0 -129.08 145.61 51.23 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.271 -174.225 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.2 m -135.57 116.36 14.03 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 168.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -155.04 179.16 9.41 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.449 -0.796 . . . . 0.0 108.994 174.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.58 -22.07 63.56 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 167.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.6 mt -81.24 10.9 4.78 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.367 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -38.13 86.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.739 0.305 . . . . 0.0 110.567 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -26.8 65.65 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.403 179.59 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -77.81 -52.37 9.0 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.377 -176.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.405 ' HB2' ' CZ ' ' A' ' 13' ' ' PHE . 50.5 m-85 -88.25 -16.69 32.52 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.347 -177.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 72.8 mm-40 53.89 54.45 9.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.308 0.575 . . . . 0.0 111.028 -177.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.34 39.51 3.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.766 -178.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -98.53 147.58 24.62 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.226 -177.25 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.635 ' SG ' ' HB2' ' A' ' 5' ' ' CYS . 1.9 m -77.98 164.13 25.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.164 178.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.62 -38.11 86.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.931 -177.102 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.43 32.88 1.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.21 0.529 . . . . 0.0 110.929 -178.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.465 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 16.8 t80 -72.17 -41.75 66.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.5 0.667 . . . . 0.0 109.676 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -30.09 70.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.236 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.21 -54.63 11.99 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.258 177.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.618 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 46.3 mm-40 -68.73 -53.13 23.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.829 -175.662 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.519 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 0.5 OUTLIER -73.15 -48.79 32.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.524 -177.805 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.68 61.33 12.6 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.935 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.519 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 64.8 Cg_endo -81.14 -42.48 0.12 Allowed 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 121.902 1.735 . . . . 0.0 111.526 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -164.13 138.18 5.53 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.335 -0.848 . . . . 0.0 108.713 -178.119 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 61.7 t -80.69 113.61 20.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.593 ' O ' ' HD3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -75.9 38.98 0.17 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.145 -0.48 . . . . 0.0 112.264 -176.446 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.593 ' HD3' ' O ' ' A' ' 44' ' ' THR . 0.0 OUTLIER -158.79 155.53 28.09 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -178.435 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -130.63 -152.3 7.35 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.086 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.0 t70 . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.349 -0.834 . . . . 0.0 109.804 -179.972 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.1 t0 . . . . . 0 N--CA 1.48 1.039 0 CA-C-O 121.287 0.565 . . . . 0.0 110.578 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.76 151.4 49.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.963 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -78.77 71.08 5.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.381 0.61 . . . . 0.0 110.128 178.033 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -150.62 161.54 42.39 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.018 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.494 ' HB3' ' HG2' ' A' ' 38' ' ' GLU . 30.0 m -112.13 122.07 46.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 176.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.454 ' HE2' ' O ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -146.58 28.91 1.05 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.063 0.459 . . . . 0.0 110.567 -178.501 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 141.97 26.28 0.18 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.799 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.43 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.2 OUTLIER -82.37 -27.38 32.15 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.494 ' HB2' ' OE1' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -70.1 -18.49 63.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.27 0.557 . . . . 0.0 110.208 -179.921 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -107.48 -11.38 15.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.355 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.92 -16.94 14.71 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.067 0.461 . . . . 0.0 110.683 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 112.67 146.05 9.75 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.812 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.561 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 10.0 t80 -56.22 107.36 0.36 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.454 0.645 . . . . 0.0 110.655 178.312 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.534 HD21 ' HA ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -83.66 81.92 8.54 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.45 179.307 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.415 HG23 ' H ' ' A' ' 15' ' ' VAL . 0.0 OUTLIER -69.97 -1.18 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.053 0.454 . . . . 0.0 110.412 -178.672 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.56 -9.28 25.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.193 179.728 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.409 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -96.63 -176.63 3.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.795 0.331 . . . . 0.0 111.344 -176.084 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -82.03 -56.09 4.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.649 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.43 138.23 48.19 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.616 -0.512 . . . . 0.0 109.616 176.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.652 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -127.82 149.63 50.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.278 -171.942 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 53.8 m -144.92 119.37 9.65 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.343 174.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.491 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 6.8 t0 -153.1 -174.8 5.07 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 169.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -68.29 -21.89 64.76 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 170.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -86.41 14.47 6.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.99 177.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.561 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -59.41 -40.96 88.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.611 178.979 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -26.03 60.64 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.004 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -66.21 -45.64 80.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.63 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -90.91 -17.0 27.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.769 0.319 . . . . 0.0 110.745 178.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 52.81 50.36 18.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.573 -174.174 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -142.04 48.24 1.6 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.079 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.652 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.64 146.77 24.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.799 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.23 160.77 27.74 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.397 177.428 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -29.5 70.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.938 -178.368 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -85.82 28.25 0.8 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.749 0.309 . . . . 0.0 111.234 -179.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -70.51 -47.58 59.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.459 0.647 . . . . 0.0 110.082 -178.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -28.88 66.42 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.997 -178.069 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.98 -48.96 74.35 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.747 178.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.494 ' HG2' ' HB3' ' A' ' 5' ' ' CYS . 0.3 OUTLIER -87.58 -40.39 14.27 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.484 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.43 ' N ' ' HG3' ' A' ' 38' ' ' GLU . 49.1 t -91.81 -55.57 3.42 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.333 -175.041 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 tttt 47.85 67.41 4.51 Favored Pre-proline 0 N--CA 1.465 0.299 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.119 -173.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.97 -47.45 17.93 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.579 2.186 . . . . 0.0 111.515 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.4 -69.6 0.07 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.182 176.177 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.55 HG13 ' HB2' ' A' ' 45' ' ' ARG . 14.2 p -162.5 151.72 3.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.559 178.719 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.68 52.1 0.8 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.076 0.465 . . . . 0.0 111.708 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.55 ' HB2' HG13 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -101.36 48.05 0.9 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.067 0.461 . . . . 0.0 111.05 -177.504 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -112.45 -7.93 21.88 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.762 -0.732 . . . . 0.0 111.799 178.096 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.7 t70 . . . . . 0 C--O 1.245 0.816 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -178.323 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 38.8 t0 . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.76 37.0 22.27 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.39 0.614 . . . . 0.0 110.323 -175.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.438 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -94.56 7.52 45.37 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.745 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.31 147.68 7.58 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.836 178.052 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 3.5 t -82.93 118.6 23.58 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.418 -176.335 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.438 ' HE2' ' O ' ' A' ' 5' ' ' CYS . 13.5 mmtt -141.63 -60.98 0.47 Allowed 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 175.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -128.32 51.68 0.85 Allowed Glycine 0 N--CA 1.444 -0.794 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.851 176.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.53 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -91.71 -21.1 20.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.113 0.482 . . . . 0.0 109.761 177.004 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -76.54 -18.12 58.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.76 -176.463 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.76 -21.16 41.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.765 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.6 -42.22 6.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.18 -179.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 122.1 179.54 15.97 Favored Glycine 0 N--CA 1.444 -0.768 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 -177.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.713 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 6.6 t80 -62.36 107.11 0.85 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.185 0.517 . . . . 0.0 110.635 177.538 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.426 ' ND2' ' HB2' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -89.3 84.59 6.48 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.852 176.161 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.462 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -68.45 -14.48 18.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.2 0.524 . . . . 0.0 109.902 -177.955 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -21.44 54.81 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.224 177.28 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.426 ' HB2' ' ND2' ' A' ' 14' ' ' ASN . 1.7 mmpp? -84.02 171.2 13.16 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.14 -9.87 37.9 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.117 0.484 . . . . 0.0 110.36 -179.011 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.438 ' HB2' ' HB2' ' A' ' 3' ' ' GLU . 1.8 t -137.2 138.2 39.93 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 172.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.576 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 26.7 mp0 -131.8 148.03 52.53 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.844 0.354 . . . . 0.0 111.86 -169.349 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.53 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 64.8 m -142.34 118.26 10.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.725 170.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -153.3 -173.7 4.67 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 167.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -19.46 63.74 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 169.468 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 mt -88.44 14.62 9.3 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.252 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.713 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -60.73 -37.38 81.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.68 0.276 . . . . 0.0 110.776 -178.578 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -26.7 60.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.245 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -68.46 -44.07 75.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.582 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -88.43 -15.75 34.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.406 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 56.8 49.5 14.14 Favored 'General case' 0 CA--C 1.522 -0.1 0 O-C-N 123.713 0.633 . . . . 0.0 110.152 -176.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.2 m -151.39 76.47 1.22 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.224 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -118.67 151.5 37.84 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.994 176.179 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 3.3 m -80.11 160.12 25.85 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.91 0.386 . . . . 0.0 110.967 177.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -26.92 68.89 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.142 0.496 . . . . 0.0 111.317 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.61 7.34 36.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.486 -177.435 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.468 ' CD1' ' HB3' ' A' ' 21' ' ' CYS . 13.5 t80 -62.59 -47.18 84.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.323 0.582 . . . . 0.0 110.123 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -32.97 63.94 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.057 -178.316 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.89 -50.45 34.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.036 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -93.1 -35.63 13.1 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -172.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 69.6 m -97.03 -55.17 2.95 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.428 -177.338 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 64.95 102.85 0.03 OUTLIER Pre-proline 0 C--O 1.232 0.153 0 O-C-N 123.612 0.57 . . . . 0.0 110.868 179.237 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -51.99 -46.69 30.77 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 123.071 2.514 . . . . 0.0 111.998 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 60.23 28.67 18.28 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.358 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 p -116.12 128.0 73.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 177.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.51 120.05 27.43 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.897 0.38 . . . . 0.0 111.312 -176.552 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -82.86 97.75 8.81 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.013 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -81.02 47.43 3.56 Favored Glycine 0 N--CA 1.454 -0.134 0 C-N-CA 121.179 -0.534 . . . . 0.0 113.169 -174.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.294 -0.86 . . . . 0.0 109.547 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.49 ' HB2' ' H ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 110.458 -0.201 . . . . 0.0 110.458 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.49 ' H ' ' HB2' ' A' ' 1' ' ' ASP . 0.8 OUTLIER -86.42 136.25 33.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.089 0.471 . . . . 0.0 111.246 -174.582 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.4 2.0 10.74 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.291 175.563 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -98.48 141.81 30.88 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.944 -170.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.406 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 6.1 t -92.49 142.55 27.29 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.687 175.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.423 ' HB2' ' HE2' ' A' ' 6' ' ' LYS . 12.6 mtmm -118.82 -78.02 0.58 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.901 0.382 . . . . 0.0 110.328 178.108 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -143.19 31.63 1.94 Allowed Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.512 -0.851 . . . . 0.0 111.884 -176.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -82.33 8.95 9.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.867 0.365 . . . . 0.0 111.188 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.478 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 25.9 m -74.66 -16.69 60.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.44 0.638 . . . . 0.0 109.563 176.485 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -110.1 10.8 23.96 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.286 -177.184 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -110.45 11.92 23.07 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.697 0.761 . . . . 0.0 109.439 175.438 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.93 161.4 32.22 Favored Glycine 0 N--CA 1.445 -0.764 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.2 -177.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -73.56 107.2 5.69 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.287 175.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.478 HD21 ' HA ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -83.81 112.18 19.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.023 178.363 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -90.57 3.51 6.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.023 0.44 . . . . 0.0 110.555 -177.614 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -138.73 53.45 1.77 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.233 0.54 . . . . 0.0 110.88 177.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.445 ' CG ' ' HB2' ' A' ' 14' ' ' ASN . 6.8 mmmm -129.51 -171.3 2.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.8 172.4 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.2 -58.42 4.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.27 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -132.05 153.41 50.45 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.515 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.523 ' HG2' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -126.7 141.7 51.76 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -171.899 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.478 ' HB3' ' SG ' ' A' ' 9' ' ' CYS . 92.7 m -139.15 119.3 13.56 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.875 0.369 . . . . 0.0 110.986 174.626 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 19.2 t70 -153.93 -172.96 4.39 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 168.29 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.37 -23.8 63.79 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 167.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.1 mt -80.5 8.92 6.72 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.346 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.442 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -61.13 -39.1 88.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.879 0.371 . . . . 0.0 110.066 179.367 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.85 -26.66 62.45 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.104 178.589 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -66.85 -42.09 86.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.68 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -96.1 -17.5 20.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.03 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 55.47 47.06 21.87 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.101 0.477 . . . . 0.0 110.941 -175.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.523 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 0.3 OUTLIER -141.94 46.73 1.65 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.183 -178.197 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -95.29 153.71 17.54 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.593 179.815 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.42 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -66.62 156.41 35.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.582 179.08 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -37.71 75.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -172.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.425 ' HB2' ' HB3' ' A' ' 37' ' ' ALA . 9.8 p30 -103.39 31.74 4.18 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.982 0.42 . . . . 0.0 110.979 -175.358 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.603 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 7.9 t80 -62.59 -42.88 99.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.492 0.663 . . . . 0.0 109.265 178.032 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.541 ' O ' ' HD3' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -73.35 -32.4 64.51 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.85 179.724 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.425 ' HB3' ' HB2' ' A' ' 34' ' ' ASP . . . -66.61 -57.62 6.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.527 -178.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -87.17 -41.9 13.4 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.187 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.603 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 52.0 t -78.94 -46.8 17.61 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.401 -175.555 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.541 ' HD3' ' O ' ' A' ' 36' ' ' THR . 0.3 OUTLIER 55.3 75.4 0.6 Allowed Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.891 177.206 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo -48.01 -49.74 13.29 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.451 2.767 . . . . 0.0 112.545 -178.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.503 ' HA ' ' OE1' ' A' ' 42' ' ' GLN . 1.9 tp-100 49.32 51.68 15.86 Favored 'General case' 0 N--CA 1.462 0.145 0 O-C-N 123.598 0.561 . . . . 0.0 111.783 178.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.512 HG12 ' HB2' ' A' ' 45' ' ' ARG . 19.1 t -95.19 112.81 28.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.033 178.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -77.68 60.23 2.15 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.057 0.456 . . . . 0.0 111.043 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.512 ' HB2' HG12 ' A' ' 43' ' ' VAL . 0.1 OUTLIER -123.58 -98.92 0.42 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.631 -178.213 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.443 ' H ' ' HB3' ' A' ' 45' ' ' ARG . . . 67.12 -139.3 35.82 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.979 -178.549 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.3 t70 . . . . . 0 C--O 1.249 1.059 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.136 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.481 ' OD2' ' HB2' ' A' ' 18' ' ' LYS . 1.7 t70 . . . . . 0 N--CA 1.48 1.046 0 CA-C-O 120.551 0.215 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -76.67 -3.98 40.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.928 0.395 . . . . 0.0 111.789 -175.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -94.42 -158.54 0.64 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.97 0.414 . . . . 0.0 110.51 179.173 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.02 170.3 13.12 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.723 0.773 . . . . 0.0 112.268 -177.543 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 38.5 t -91.28 125.17 35.96 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.189 177.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.78 4.98 43.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.266 0.555 . . . . 0.0 110.021 177.257 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.601 ' HA2' ' SG ' ' A' ' 39' ' ' CYS . . . 114.71 55.84 0.38 Allowed Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.561 -174.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.666 ' HG3' ' SG ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -84.08 7.14 19.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.469 0.652 . . . . 0.0 109.953 -178.908 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.477 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 16.4 m -72.34 -3.79 25.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.348 176.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 15.7 p -79.77 -24.61 41.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.474 0.654 . . . . 0.0 109.715 172.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -95.57 -22.8 17.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.493 -177.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.72 177.0 45.46 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 -176.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.696 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 4.0 t80 -72.87 108.39 5.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.145 0.497 . . . . 0.0 110.741 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.538 ' HB3' ' HB2' ' A' ' 17' ' ' LYS . 7.6 t-20 -96.74 106.97 19.35 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 172.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -75.49 -3.77 5.26 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.228 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -94.11 -6.86 44.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.752 176.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.538 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -94.69 159.95 14.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.843 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.585 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -84.53 -34.24 23.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.774 0.321 . . . . 0.0 110.567 -174.85 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -120.0 138.44 53.49 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 171.218 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.584 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 22.1 mp0 -127.01 140.89 51.97 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.735 -173.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.666 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -135.1 115.59 13.61 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.171 167.429 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.602 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 24.8 t70 -155.78 179.35 9.28 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.031 173.095 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -68.63 -26.76 65.51 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 168.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mt -76.95 5.89 7.18 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.466 177.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.696 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -61.34 -38.44 86.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.828 0.346 . . . . 0.0 110.547 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.99 -27.51 64.76 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.914 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -70.7 -46.87 62.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.903 -178.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -88.21 -12.79 42.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.658 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 55.17 47.67 21.21 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 121.639 0.733 . . . . 0.0 109.643 -174.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 16.5 m -145.12 77.76 1.53 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.189 -177.192 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.584 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -126.8 151.18 48.63 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.333 175.378 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.6 m -73.85 141.43 46.13 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 172.466 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -31.59 64.08 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -174.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.42 21.93 1.36 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.444 -177.409 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.477 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 19.2 t80 -67.99 -49.37 62.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.301 0.572 . . . . 0.0 110.324 -177.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.433 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 0.3 OUTLIER -73.6 -29.98 62.72 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.648 -176.427 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.87 -45.79 66.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.517 177.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -89.02 -53.91 4.37 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -174.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.601 ' SG ' ' HA2' ' A' ' 7' ' ' GLY . 1.4 m -76.2 -40.21 52.84 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.365 -175.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.76 92.05 0.07 OUTLIER Pre-proline 0 N--CA 1.464 0.237 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.386 175.258 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 36' ' ' THR . 2.4 Cg_endo -81.1 -149.05 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.028 2.486 . . . . 0.0 111.365 175.179 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -132.25 15.58 4.59 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.106 -179.206 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 67.8 t 66.93 101.39 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 CA-C-N 116.114 -0.493 . . . . 0.0 109.819 -173.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.76 83.77 0.3 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.471 -175.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -119.78 116.56 26.16 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 173.512 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -76.64 -25.94 64.1 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.479 -179.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.079 0 CA-C-O 117.852 -1.07 . . . . 0.0 109.435 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.481 1.102 0 CA-C-O 119.909 -0.091 . . . . 0.0 110.831 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.37 83.07 0.14 Allowed 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.262 0.554 . . . . 0.0 110.04 -175.542 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.455 ' HA ' ' SG ' ' A' ' 32' ' ' CYS . 12.2 tp10 -69.71 97.23 1.04 Allowed 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.707 -172.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -168.38 107.38 0.5 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.649 175.184 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.792 ' SG ' ' HB2' ' A' ' 32' ' ' CYS . 84.0 m -97.55 162.83 13.11 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 168.442 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.48 -101.3 0.09 Allowed 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.851 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -96.13 4.79 65.33 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.217 -0.753 . . . . 0.0 111.217 -177.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.489 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 5.5 ptt-85 -79.61 66.77 5.18 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 122.063 0.935 . . . . 0.0 108.988 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.465 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -148.11 10.87 0.91 Allowed 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.744 166.685 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -145.9 9.93 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.59 177.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.424 ' HG3' ' HA ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -104.87 -27.49 11.69 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.75 -175.838 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 119.2 145.49 7.65 Favored Glycine 0 N--CA 1.444 -0.832 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 -173.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.67 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 12.9 t80 -69.91 107.37 3.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 121.312 0.577 . . . . 0.0 110.716 -174.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -84.55 97.62 9.68 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.421 174.41 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.654 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -87.32 28.83 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.216 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -135.87 19.58 3.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.515 -175.368 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.89 -176.1 2.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.605 179.573 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.93 -60.39 2.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.4 t -100.26 138.88 36.73 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 172.082 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.575 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.1 mp0 -108.6 135.35 50.0 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.923 0.392 . . . . 0.0 110.279 -175.075 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.516 ' SG ' ' HD1' ' A' ' 35' ' ' TYR . 0.8 OUTLIER -156.3 122.23 4.94 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.946 175.127 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.465 ' HA ' ' HA ' ' A' ' 9' ' ' CYS . 3.4 t70 -155.83 -169.03 2.96 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 160.495 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -14.53 62.96 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.181 0.515 . . . . 0.0 110.154 174.092 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.78 12.38 30.22 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.227 179.357 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.67 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -54.57 -40.45 68.79 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.634 0.254 . . . . 0.0 111.309 178.861 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -37.38 78.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.917 0.389 . . . . 0.0 111.028 -179.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -62.54 -48.31 80.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.679 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -81.83 -15.7 53.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.108 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 56.09 47.65 19.21 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.506 0.669 . . . . 0.0 110.334 -176.609 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.0 m -150.68 77.21 1.28 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.971 -177.323 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.575 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -125.9 157.26 38.15 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.27 174.994 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.792 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 2.6 m -71.02 158.84 35.81 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 174.452 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.12 -29.69 69.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.965 -173.218 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -94.38 32.97 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.483 0.658 . . . . 0.0 111.047 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.516 ' HD1' ' SG ' ' A' ' 21' ' ' CYS . 45.6 t80 -62.18 -38.72 90.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.583 179.297 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.535 ' O ' ' HA ' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -69.96 -29.01 66.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.986 -179.814 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.72 -45.73 67.54 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.143 0.497 . . . . 0.0 111.006 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -82.11 -51.33 8.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.084 -175.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.6 t -75.65 -41.35 54.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.912 0.387 . . . . 0.0 110.206 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.535 ' HA ' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 63.19 66.59 1.16 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.277 -0.874 . . . . 0.0 113.038 175.875 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -81.94 -172.11 1.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.205 1.937 . . . . 0.0 110.617 170.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.86 136.81 12.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.006 0.431 . . . . 0.0 111.023 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 49.1 t -122.39 132.44 71.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 174.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.97 104.81 0.15 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.232 0.539 . . . . 0.0 111.806 -177.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -122.71 49.92 1.57 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.214 -178.621 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 172.51 38.48 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.243 -0.979 . . . . 0.0 112.538 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.2 t0 . . . . . 0 C--O 1.243 0.735 0 CA-C-O 118.655 -0.688 . . . . 0.0 109.563 177.8 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.719 0.295 . . . . 0.0 111.305 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -89.42 101.56 14.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.039 0.447 . . . . 0.0 111.751 -177.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.49 13.8 27.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.732 0.777 . . . . 0.0 109.879 173.501 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.14 153.13 34.51 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.074 179.006 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.448 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -64.94 120.84 13.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.739 -178.975 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.66 -70.7 0.76 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 173.812 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.26 61.15 0.63 Allowed Glycine 0 N--CA 1.439 -1.113 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.364 177.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.8 ptp180 -130.62 8.27 4.92 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.837 0.351 . . . . 0.0 110.176 175.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.735 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 83.5 m -103.18 19.55 19.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.634 0.731 . . . . 0.0 109.486 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.84 -46.7 1.97 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.069 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.54 -54.18 46.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.84 174.08 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 149.88 175.39 22.04 Favored Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 121.058 -0.592 . . . . 0.0 111.765 -179.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.581 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 30.0 t80 -65.81 113.91 4.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.163 0.506 . . . . 0.0 111.185 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.662 HD21 ' HA ' ' A' ' 20' ' ' GLN . 0.7 OUTLIER -81.89 116.04 21.36 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.667 172.125 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.401 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.2 OUTLIER -97.85 -11.34 8.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-O 121.439 0.637 . . . . 0.0 109.398 177.324 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -33.92 37.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.38 179.184 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 3.1 mmtm -70.69 -178.64 1.9 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.167 0.508 . . . . 0.0 111.96 -174.304 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.82 -47.25 7.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.725 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -109.55 139.49 44.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.491 174.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.699 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -123.2 142.16 51.2 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 120.826 0.346 . . . . 0.0 111.385 -174.089 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.735 ' HB3' ' SG ' ' A' ' 9' ' ' CYS . 1.3 m -145.82 115.9 7.42 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.048 172.385 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.619 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 21.3 t70 -156.39 -176.95 6.24 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.422 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.6 -33.92 75.97 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 166.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.63 5.24 3.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.884 178.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.619 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -64.33 -33.63 76.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 -179.631 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.09 -25.92 64.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.783 178.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -73.19 -34.18 65.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.942 -178.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -102.9 -16.39 15.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.673 0.273 . . . . 0.0 111.134 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 59.11 36.47 24.13 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.397 -178.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -133.07 51.84 2.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.404 -177.281 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.699 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -97.51 148.27 23.41 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.338 177.902 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.441 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 1.8 m -74.53 162.22 29.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.658 178.307 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.46 -25.19 67.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.929 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.37 12.06 9.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.66 -176.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.435 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 31.0 t80 -63.53 -50.28 70.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.558 0.694 . . . . 0.0 110.754 -176.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -29.52 62.17 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.326 -176.45 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.69 -54.51 18.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.089 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -84.06 -53.27 5.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 0.0 112.034 -174.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.8 m -77.7 -47.95 17.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.182 -171.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.94 73.09 0.89 Allowed Pre-proline 0 N--CA 1.465 0.316 0 O-C-N 123.541 0.525 . . . . 0.0 111.395 178.015 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.516 ' HB2' HG23 ' A' ' 43' ' ' VAL . 17.9 Cg_endo -60.18 -42.3 44.13 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.561 2.174 . . . . 0.0 112.223 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 56.16 36.65 27.79 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.04 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.516 HG23 ' HB2' ' A' ' 41' ' ' PRO . 35.5 t -91.58 95.14 5.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.702 -178.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.51 -51.62 16.43 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.272 0.558 . . . . 0.0 110.346 176.072 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -131.58 102.58 5.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.178 179.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -113.49 33.86 5.31 Favored Glycine 0 N--CA 1.454 -0.148 0 C-N-CA 121.086 -0.578 . . . . 0.0 111.751 179.225 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.737 0 CA-C-O 118.175 -0.917 . . . . 0.0 109.306 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 14.5 t0 . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 56.83 54.56 7.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.266 0.555 . . . . 0.0 110.534 -175.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 43.8 mp0 -78.91 -111.44 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.349 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.98 159.01 29.22 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.952 0.406 . . . . 0.0 111.2 -178.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.458 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 4.7 t -99.34 169.3 9.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.365 178.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.544 ' HG3' ' N ' ' A' ' 7' ' ' GLY . 0.5 OUTLIER 176.96 -36.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.844 175.149 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.544 ' N ' ' HG3' ' A' ' 6' ' ' LYS . . . -147.89 62.27 0.44 Allowed Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.832 -0.699 . . . . 0.0 111.955 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.613 ' HG3' ' SG ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -120.91 -40.14 2.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.99 0.424 . . . . 0.0 110.022 174.253 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 33.4 m -64.26 -19.66 65.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.256 0.551 . . . . 0.0 110.4 179.148 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -81.27 -15.08 56.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.64 -178.004 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.403 ' H ' ' HG2' ' A' ' 11' ' ' GLU . 0.1 OUTLIER -121.93 -4.75 9.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.738 -176.533 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.7 -175.16 51.98 Favored Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 111.321 -0.712 . . . . 0.0 111.321 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -69.4 109.74 4.34 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.224 0.535 . . . . 0.0 111.619 -177.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -92.21 102.07 14.58 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.088 169.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -78.32 47.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.962 0.886 . . . . 0.0 109.968 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -138.09 -35.42 0.63 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.771 -179.108 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.518 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -71.13 166.93 20.39 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.652 -174.986 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.3 -37.13 16.24 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.861 -175.635 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -103.98 137.63 41.68 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 172.394 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.543 ' HB2' ' O ' ' A' ' 30' ' ' SER . 24.2 mp0 -121.63 121.79 38.16 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.243 -173.5 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.613 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -139.57 115.45 10.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.993 0.425 . . . . 0.0 110.116 170.599 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -155.99 -175.17 5.29 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -68.75 -32.36 72.07 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 165.27 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.7 mt -78.68 7.39 6.96 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.816 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.17 -33.8 76.88 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -26.86 62.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.588 178.685 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.423 ' HD2' ' CE1' ' A' ' 28' ' ' TYR . 35.7 t80 -67.97 -43.8 78.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.607 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.423 ' CE1' ' HD2' ' A' ' 27' ' ' TYR . 93.8 m-85 -86.29 -16.06 38.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.848 0.356 . . . . 0.0 110.551 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 60.82 38.58 17.88 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.603 -178.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.543 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 5.7 m -145.5 72.85 1.33 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.316 -177.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -101.09 156.94 17.12 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.164 177.161 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 58.7 m -62.88 144.94 56.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.549 175.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.91 -26.98 67.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.184 178.449 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.05 26.57 7.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.76 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.494 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 11.6 t80 -65.93 -38.34 88.41 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.509 0.671 . . . . 0.0 109.633 -177.495 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.15 -33.77 63.63 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.184 178.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.61 -50.17 39.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.84 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -87.81 -45.97 9.85 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.149 -173.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.494 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 35.3 t -88.28 -37.08 16.32 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.915 -0.314 . . . . 0.0 111.06 -173.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt 62.46 84.6 0.19 Allowed Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 112.659 0.615 . . . . 0.0 112.659 172.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -86.89 27.21 0.58 Allowed 'Trans proline' 0 CA--C 1.534 0.525 0 C-N-CA 123.134 2.556 . . . . 0.0 112.385 175.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -18.13 105.29 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.435 1.494 . . . . 0.0 113.626 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -80.2 141.87 14.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.02 -177.502 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.53 159.39 30.4 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.469 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.74 150.86 20.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.848 -178.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 131.57 -32.98 2.84 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.434 178.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 t70 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.818 -0.611 . . . . 0.0 110.189 -178.876 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.517 0 CA-C-O 120.909 0.385 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.493 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 1.2 m -91.99 128.3 37.78 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-O 120.959 0.409 . . . . 0.0 111.356 -178.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.93 -99.02 0.34 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.884 175.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.68 6.84 74.23 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.948 -177.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.533 ' HA ' ' OE1' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -85.94 45.54 1.23 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.147 0.498 . . . . 0.0 110.078 -176.423 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.3 t -133.76 17.06 3.91 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.603 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.73 -38.01 2.42 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.588 -176.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.533 ' OE1' ' HA ' ' A' ' 8' ' ' ARG . 2.4 pm0 -72.92 -26.58 61.45 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.818 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 126.59 175.07 14.01 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.654 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.41 ' HD2' ' HB3' ' A' ' 22' ' ' ASP . 18.5 t80 -68.5 116.04 8.6 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.9 0.381 . . . . 0.0 111.334 -176.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.47 97.84 6.57 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 170.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -80.07 -2.86 5.77 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-O 121.304 0.573 . . . . 0.0 109.644 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -119.79 46.79 1.86 Allowed 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.384 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.58 172.11 12.29 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 171.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.13 -21.79 42.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.225 0.536 . . . . 0.0 110.171 178.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 t -149.18 138.48 21.54 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.027 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.575 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -130.68 151.98 50.53 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -168.151 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.5 m -142.46 120.13 11.83 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.573 172.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.538 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 28.7 t0 -154.31 -179.54 8.03 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 170.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.62 -22.54 65.33 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 167.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.6 mt -85.53 14.21 5.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.119 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.538 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -61.23 -39.3 89.8 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 178.707 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.29 -25.96 59.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.799 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -67.5 -47.83 68.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.731 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -90.04 -16.06 30.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.641 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 58.86 50.53 8.43 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.423 0.63 . . . . 0.0 110.085 -173.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -147.92 78.22 1.44 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.506 -177.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.575 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.1 OUTLIER -127.73 147.42 50.4 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.325 175.162 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 5' ' ' CYS . 4.1 m -73.84 169.42 17.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.156 0.503 . . . . 0.0 111.741 178.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.65 -28.27 64.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.471 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.493 ' OD1' ' HB2' ' A' ' 5' ' ' CYS . 0.4 OUTLIER -89.56 17.05 6.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.763 0.316 . . . . 0.0 110.772 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -67.11 -48.03 69.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.564 0.697 . . . . 0.0 109.579 178.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -29.72 64.22 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.752 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.99 -57.79 4.59 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.388 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 24.5 mm-40 -78.96 -42.6 26.41 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -173.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.1 t -84.12 -55.4 4.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.363 -174.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 mttt 61.52 76.16 0.41 Allowed Pre-proline 0 N--CA 1.467 0.408 0 CA-C-O 121.103 0.478 . . . . 0.0 110.429 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo . . . . . 0 C--N 1.344 0.327 0 C-N-CA 122.67 2.246 . . . . 0.0 113.402 -174.58 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.388 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.638 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -86.27 121.69 29.2 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.804 -178.065 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -151.51 -88.32 0.06 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.461 -0.791 . . . . 0.0 108.999 176.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.46 34.43 2.9 Favored Glycine 0 N--CA 1.451 -0.366 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.136 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.495 ' HD2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -128.13 10.54 6.38 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.831 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.634 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 4.0 t -115.0 -11.29 12.15 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 173.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.88 -6.06 20.53 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.191 -177.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.489 ' HG2' ' HA ' ' A' ' 8' ' ' ARG . 22.0 pt-20 -105.05 -14.56 15.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.988 -177.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.21 149.94 25.86 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.915 -176.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.445 ' CE2' ' HG2' ' A' ' 20' ' ' GLN . 2.6 t80 -56.94 109.12 0.59 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.11 0.481 . . . . 0.0 111.869 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.461 ' C ' ' H ' ' A' ' 16' ' ' ASP . 54.7 t30 -99.98 113.46 26.05 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 170.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.2 t -78.83 39.08 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.818 0.818 . . . . 0.0 110.509 -177.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.461 ' H ' ' C ' ' A' ' 14' ' ' ASN . 24.5 t0 -151.35 29.19 0.63 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.036 173.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.617 ' HB2' HE22 ' A' ' 20' ' ' GLN . 7.0 mmtp -110.09 155.06 22.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.468 175.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -74.09 0.11 Allowed 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.324 0.39 . . . . 0.0 111.032 178.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -102.4 154.97 18.57 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 174.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.617 HE22 ' HB2' ' A' ' 17' ' ' LYS . 1.1 tp-100 -138.62 146.71 42.05 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -171.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.634 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 39.8 m -140.56 117.69 11.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.21 -0.904 . . . . 0.0 108.866 168.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.534 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 10.7 t70 -154.76 179.4 9.12 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -69.38 -35.11 75.48 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 165.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 40.7 mt -74.93 2.29 10.73 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.393 178.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.534 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -63.72 -33.74 76.32 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 178.218 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -36.12 63.09 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.128 0.489 . . . . 0.0 110.488 176.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -62.76 -46.45 87.98 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.431 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -89.44 -8.74 52.37 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.338 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 52.91 47.22 25.15 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.201 0.524 . . . . 0.0 111.473 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.4 m -148.06 73.41 1.26 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.604 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -120.15 152.08 38.16 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.852 0.358 . . . . 0.0 110.883 177.216 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.489 ' SG ' ' SG ' ' A' ' 5' ' ' CYS . 1.6 m -76.34 159.06 30.88 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.101 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -25.87 67.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.012 0.434 . . . . 0.0 111.515 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.2 15.62 4.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.798 -177.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.447 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 23.3 t80 -65.79 -50.8 63.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.425 0.631 . . . . 0.0 110.162 -177.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.13 -29.5 62.94 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.048 -176.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.86 -49.91 59.47 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.212 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.638 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 31.1 mm-40 -84.35 -51.38 7.01 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.26 -0.427 . . . . 0.0 112.15 -174.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.09 -42.55 23.41 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.852 -175.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.18 56.32 14.1 Favored Pre-proline 0 N--CA 1.469 0.475 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 177.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo . . . . . 0 C--N 1.347 0.488 0 C-N-CA 122.22 1.946 . . . . 0.0 112.726 -178.31 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m . . . . . 0 N--CA 1.445 -0.68 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.598 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -71.09 149.52 46.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.635 -175.387 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -144.48 -104.42 0.11 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.138 173.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -89.72 37.5 3.34 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.961 -0.638 . . . . 0.0 113.438 -173.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.554 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -74.18 -26.39 60.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.003 0.43 . . . . 0.0 110.025 177.54 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.412 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 0.8 OUTLIER -72.71 -23.85 60.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.754 -174.676 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.64 -36.13 16.43 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.906 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -71.36 -43.33 67.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.274 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 119.65 175.03 15.76 Favored Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 111.364 -0.694 . . . . 0.0 111.364 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.425 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 4.2 t80 -76.02 107.63 8.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.166 0.508 . . . . 0.0 110.515 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -93.23 100.79 13.09 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.737 174.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.3 t -77.44 52.23 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.853 0.835 . . . . 0.0 110.457 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -151.67 -30.66 0.16 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.188 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.553 ' HB2' HE22 ' A' ' 20' ' ' GLN . 0.1 OUTLIER -77.02 163.43 26.69 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.17 176.278 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -77.61 -62.9 1.51 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.245 -171.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.74 138.61 34.04 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.579 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -130.86 142.91 50.41 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.703 -173.086 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.554 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 92.6 m -135.72 118.01 15.62 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 170.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.468 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 14.9 t70 -153.77 178.54 9.77 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 177.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.81 -25.87 63.98 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 166.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.446 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 0.3 OUTLIER -80.74 14.32 2.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.511 176.205 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.468 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -63.46 -47.52 81.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.551 -178.739 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.72 -25.61 66.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.224 0.535 . . . . 0.0 110.928 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.446 ' HB3' ' O ' ' A' ' 24' ' ' LEU . 78.0 t80 -63.29 -39.03 93.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.784 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -105.01 -16.44 14.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.414 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 58.1 38.78 26.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.284 0.564 . . . . 0.0 110.717 -177.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.4 m -127.57 41.47 3.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.761 -177.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.88 150.1 21.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.624 -179.538 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.0 m -73.24 154.11 40.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.333 177.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.87 -37.45 79.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.92 0.391 . . . . 0.0 111.773 -178.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.14 40.22 1.04 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.593 0.711 . . . . 0.0 110.889 -179.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.422 ' HD1' ' SG ' ' A' ' 21' ' ' CYS . 19.8 t80 -70.87 -42.78 69.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.688 178.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -31.8 72.97 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.354 -178.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.88 -43.56 79.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.804 -178.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.598 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 63.7 mm-40 -95.0 -37.59 11.06 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -173.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.9 t -82.38 -48.86 10.65 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.367 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 47.93 62.86 11.26 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.102 -177.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo . . . . . 0 C--N 1.345 0.377 0 C-N-CA 122.694 2.263 . . . . 0.0 113.299 -171.833 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 120.886 0.374 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.523 ' HA ' ' HG3' ' A' ' 8' ' ' ARG . 30.3 m -100.29 131.85 45.99 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.439 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.13 -68.63 0.87 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.13 0.49 . . . . 0.0 109.839 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -115.32 29.89 7.05 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 178.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.523 ' HG3' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -96.66 61.3 1.89 Allowed 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 -176.204 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -166.92 45.25 0.06 Allowed 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.34 -1.3 . . . . 0.0 109.323 171.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -163.86 -37.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.205 -175.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -77.63 -31.06 52.57 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.783 -176.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 115.41 162.02 13.32 Favored Glycine 0 N--CA 1.439 -1.131 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -170.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -59.25 114.37 2.6 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 117.145 0.472 . . . . 0.0 111.389 -175.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -77.88 85.86 4.12 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.734 174.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.407 HG23 ' H ' ' A' ' 15' ' ' VAL . 0.0 OUTLIER -71.73 -6.45 7.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 121.263 0.554 . . . . 0.0 109.627 179.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.13 -32.48 50.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.82 174.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.531 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -72.3 172.71 9.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.411 0.624 . . . . 0.0 112.094 -168.452 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.49 -51.28 5.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.307 -179.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.6 t -103.63 138.4 40.34 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 169.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.717 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.8 mm-40 -118.98 132.44 56.07 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.469 0.652 . . . . 0.0 112.652 -167.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.413 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -138.59 119.49 14.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.625 169.235 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.439 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 5.9 t70 -156.64 -168.78 2.79 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 165.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.19 -29.31 70.68 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.736 0.779 . . . . 0.0 108.952 169.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.435 HD23 ' CD2' ' A' ' 27' ' ' TYR . 0.4 OUTLIER -89.07 14.66 10.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.667 -178.148 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.439 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -62.22 -37.99 87.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.623 0.249 . . . . 0.0 110.862 -178.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.85 -26.7 63.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.934 0.397 . . . . 0.0 111.011 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.435 ' CD2' HD23 ' A' ' 24' ' ' LEU . 58.5 t80 -67.42 -36.32 81.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.943 -178.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -100.72 -15.69 17.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.91 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 53.53 58.54 5.08 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.075 -178.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.7 m -148.77 48.42 1.01 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.472 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.717 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.63 138.08 34.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.908 0.385 . . . . 0.0 111.397 -176.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.13 162.23 28.69 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.837 177.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -27.22 68.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.257 0.551 . . . . 0.0 111.018 177.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.87 -10.29 59.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.37 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.451 ' CE2' ' HG3' ' A' ' 41' ' ' PRO . 31.7 t80 -67.33 -46.66 72.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.361 0.601 . . . . 0.0 110.048 -176.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.61 -29.35 62.32 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.64 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.87 -50.42 42.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.429 178.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.411 ' OE1' ' HA ' ' A' ' 38' ' ' GLU . 4.9 mm-40 -88.71 -43.26 11.43 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -173.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.0 t -84.33 -42.96 15.24 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.592 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.93 65.36 3.35 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.251 178.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.451 ' HG3' ' CE2' ' A' ' 35' ' ' TYR . 87.8 Cg_endo . . . . . 0 C--N 1.345 0.37 0 C-N-CA 122.375 2.05 . . . . 0.0 111.017 175.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.446 -0.641 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -85.44 138.33 32.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.794 -176.65 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -125.9 -52.1 1.56 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 173.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -166.22 43.26 0.27 Allowed Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.662 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.424 ' HD2' ' SG ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -95.44 12.42 29.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.412 0.625 . . . . 0.0 109.99 177.925 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -79.89 -2.59 44.3 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.433 179.624 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.94 -1.78 18.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.346 -178.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -98.49 -8.78 26.07 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.719 0.295 . . . . 0.0 110.743 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.68 162.32 35.96 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.138 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.579 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 4.5 t80 -74.77 106.87 6.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.278 0.561 . . . . 0.0 110.438 177.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.479 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -99.85 102.27 13.64 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.099 174.523 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.576 HG13 ' HE1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -78.54 41.13 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.12 0.486 . . . . 0.0 110.758 -175.569 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -166.69 24.32 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.033 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.479 ' HG2' ' HB3' ' A' ' 14' ' ' ASN . 9.0 mmtm -89.3 -103.44 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.175 0.512 . . . . 0.0 110.228 176.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.432 ' HG3' ' C ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -150.48 -56.06 0.16 Allowed 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.161 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -124.84 147.76 48.58 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.465 171.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.637 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 2.7 mp0 -125.32 131.66 53.0 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.898 0.38 . . . . 0.0 111.679 -171.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.46 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 11.4 m -137.88 118.98 14.42 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 170.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -152.1 -170.62 3.69 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -69.05 -30.92 69.36 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 167.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mt -85.66 14.99 5.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.843 -178.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.578 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -63.55 -39.49 94.54 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 178.401 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.99 -28.52 62.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.833 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -65.49 -47.37 76.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.708 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -89.33 -11.97 41.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.008 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 53.81 43.78 30.49 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.175 0.512 . . . . 0.0 110.516 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 m -139.55 58.59 1.61 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.874 -176.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.637 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -110.48 156.0 21.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.329 177.096 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.6 m -72.48 156.2 39.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.491 177.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -22.34 66.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.988 -177.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.46 21.48 12.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.107 -177.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.483 ' O ' ' HB2' ' A' ' 39' ' ' CYS . 20.8 t80 -60.82 -50.96 71.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.119 0.485 . . . . 0.0 110.683 -177.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.471 ' O ' ' HE2' ' A' ' 40' ' ' LYS . 0.8 OUTLIER -72.98 -30.27 63.68 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.381 -177.383 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.72 -46.33 66.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.655 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 71.6 mm-40 -95.86 -39.99 9.54 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -173.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 96.0 m -82.43 -44.45 16.05 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.808 -178.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.471 ' HE2' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 59.32 78.0 0.36 Allowed Pre-proline 0 CA--C 1.531 0.221 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.147 179.851 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo . . . . . 0 CA--C 1.531 0.354 0 C-N-CA 122.829 2.353 . . . . 0.0 112.589 -179.632 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.452 -0.36 0 CA-C-O 121.114 0.483 . . . . 0.0 111.315 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.559 ' H ' ' HB2' ' A' ' 34' ' ' ASP . 3.1 t -85.48 143.24 28.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.537 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.34 -89.83 0.51 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.851 0.358 . . . . 0.0 110.064 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.98 47.12 1.04 Allowed Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.711 -0.757 . . . . 0.0 111.646 178.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.468 ' HB2' ' NH1' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.27 8.23 36.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.112 0.482 . . . . 0.0 110.341 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.3 -15.04 48.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.35 0.595 . . . . 0.0 109.96 177.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.36 -10.12 59.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.177 -178.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -102.15 -5.89 23.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.546 178.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 79.15 -177.56 54.16 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.266 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -72.11 108.55 5.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.02 0.438 . . . . 0.0 110.798 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.42 ' C ' ' H ' ' A' ' 16' ' ' ASP . 2.0 t30 -99.14 105.57 17.66 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.583 172.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.405 HG23 ' H ' ' A' ' 15' ' ' VAL . 0.2 OUTLIER -78.8 41.28 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.667 0.746 . . . . 0.0 110.157 -179.127 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.42 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -128.35 -20.87 3.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.056 -0.974 . . . . 0.0 110.128 178.391 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 29.8 mmtm -91.31 -175.02 4.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.218 0.532 . . . . 0.0 111.495 -173.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.524 ' H ' ' HD2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -87.5 -69.52 0.68 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.248 -177.624 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.27 139.19 35.29 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 174.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.581 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -126.32 148.84 49.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.815 0.34 . . . . 0.0 110.886 -175.813 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 69.1 m -133.8 116.59 15.88 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 171.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.419 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 14.4 t70 -154.12 178.0 10.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.182 176.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.96 -27.21 64.55 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 168.753 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.404 ' N ' ' HG3' ' A' ' 23' ' ' GLU . 54.1 mt -82.46 14.7 2.88 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.406 178.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -58.63 -40.68 84.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.702 0.287 . . . . 0.0 110.743 -179.584 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -25.9 59.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.032 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -64.83 -49.4 70.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.584 -178.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -88.68 -15.92 33.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.844 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.69 48.85 5.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.308 -176.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 44.0 m -149.13 73.21 1.2 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.763 -178.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -114.42 149.01 36.86 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.021 177.004 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -75.63 152.76 37.57 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 175.934 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.85 -33.52 74.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -174.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.559 ' HB2' ' H ' ' A' ' 5' ' ' CYS . 0.8 OUTLIER -86.58 24.52 1.41 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.593 -176.568 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.482 ' O ' ' HB2' ' A' ' 39' ' ' CYS . 19.5 t80 -67.27 -50.72 59.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.231 0.539 . . . . 0.0 110.455 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.508 ' O ' ' HE3' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -73.65 -30.59 63.02 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.347 -175.783 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.69 -53.52 18.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.505 -178.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -90.76 -37.76 13.46 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -172.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 73.6 m -82.08 -55.93 4.26 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.179 -176.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.508 ' HE3' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 60.64 79.81 0.28 Allowed Pre-proline 0 N--CA 1.463 0.203 0 O-C-N 123.427 0.454 . . . . 0.0 110.904 179.609 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo . . . . . 0 CA--C 1.532 0.386 0 C-N-CA 123.119 2.546 . . . . 0.0 113.333 -176.566 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.655 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.575 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 1.6 t -87.91 142.82 27.5 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.834 0.35 . . . . 0.0 110.742 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.44 ' HA ' ' HG3' ' A' ' 38' ' ' GLU . 14.4 mmtt -134.58 -79.42 0.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.722 175.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -132.82 59.85 0.68 Allowed Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.025 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.564 ' NH2' ' HB3' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -128.44 28.76 5.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.054 0.454 . . . . 0.0 110.218 178.413 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.1 OUTLIER -110.46 -11.51 14.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.283 177.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.32 -12.48 40.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.506 -177.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -96.91 -18.37 19.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.724 -177.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 118.94 -176.55 16.12 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.473 -177.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.676 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 9.4 t80 -81.73 108.34 15.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.881 0.372 . . . . 0.0 110.62 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -79.14 94.16 5.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.013 174.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.496 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -86.11 36.03 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-O 121.286 0.565 . . . . 0.0 110.519 -177.972 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -138.06 -13.23 1.42 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.823 -176.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.439 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 1.0 OUTLIER -92.84 -172.27 2.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.229 0.538 . . . . 0.0 111.963 -170.554 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.21 -17.3 46.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.258 -179.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.564 ' HB3' ' NH2' ' A' ' 8' ' ' ARG . 5.6 t -162.81 142.12 8.94 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.091 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.582 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -127.44 150.97 49.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.78 0.324 . . . . 0.0 111.311 -171.281 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.511 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 86.9 m -142.1 117.73 10.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.271 173.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.463 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 17.5 t70 -153.81 -177.77 6.61 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 171.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -68.61 -28.97 67.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 167.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mt -77.39 12.12 1.68 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.508 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.676 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -57.34 -42.57 82.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.074 179.51 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.44 -27.16 60.48 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.916 0.389 . . . . 0.0 111.084 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -67.41 -44.26 79.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.404 -178.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -90.72 -16.06 29.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.932 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 56.9 54.34 7.21 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.138 -174.102 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.2 m -154.34 76.64 1.04 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.156 -178.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.582 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -125.16 148.48 48.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.505 176.789 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.575 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 5.4 m -70.89 154.37 41.88 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.555 175.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.99 -28.74 69.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.617 -178.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.74 21.56 4.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.045 -178.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -65.36 -47.33 76.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.762 0.792 . . . . 0.0 109.285 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.446 ' O ' ' HE2' ' A' ' 40' ' ' LYS . 0.5 OUTLIER -74.06 -29.71 62.03 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.014 -179.755 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.71 -40.6 76.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.853 -177.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.44 ' HG3' ' HA ' ' A' ' 6' ' ' LYS . 64.8 mm-40 -98.38 -51.01 4.11 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -175.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 4.3 m -73.52 -34.68 65.38 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -177.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.446 ' HE2' ' O ' ' A' ' 36' ' ' THR . 0.2 OUTLIER 52.04 75.54 0.64 Allowed Pre-proline 0 N--CA 1.465 0.287 0 O-C-N 123.66 0.6 . . . . 0.0 112.232 173.892 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo . . . . . 0 CA--C 1.529 0.264 0 C-N-CA 123.327 2.685 . . . . 0.0 111.748 176.562 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.7 m . . . . . 0 N--CA 1.446 -0.642 0 CA-C-O 121.1 0.476 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.636 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -78.55 127.64 32.43 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.094 178.539 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.453 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -98.71 -88.08 0.33 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.324 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.32 49.33 0.92 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 120.678 -0.772 . . . . 0.0 111.979 177.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.636 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 4.8 mmt85 -76.05 -6.83 52.9 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.826 0.346 . . . . 0.0 110.782 -175.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.413 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 23.7 m -79.53 -7.4 58.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.226 -176.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.54 -36.58 10.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.649 0.262 . . . . 0.0 111.062 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.39 -46.97 29.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.988 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 124.02 -178.69 16.37 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.013 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.665 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 4.0 t80 -79.53 108.5 13.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.879 0.371 . . . . 0.0 111.559 -178.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -94.44 105.09 17.05 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 168.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 t -64.41 -21.52 29.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.264 0.554 . . . . 0.0 109.916 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -94.54 41.04 1.09 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.074 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.472 ' HD2' ' HA ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -119.27 165.55 14.12 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 170.271 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.64 -19.51 27.62 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.336 0.589 . . . . 0.0 110.143 -176.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.7 t -146.55 139.47 25.41 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 175.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.617 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -130.15 142.39 50.59 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -171.053 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.455 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 66.1 m -138.18 117.32 12.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.546 167.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.458 ' H ' ' HB3' ' A' ' 25' ' ' CYS . 35.7 t0 -154.9 179.97 8.61 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 175.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -15.53 63.42 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 166.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.8 mt -89.9 0.25 57.17 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.376 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.665 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -66.27 -25.58 66.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.735 0.303 . . . . 0.0 110.802 -176.337 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -39.82 62.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.896 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -63.35 -40.37 97.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.972 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -88.44 -15.44 35.44 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.321 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 54.64 45.28 27.15 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.53 -177.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.27 70.19 1.22 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.185 -178.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.617 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -109.61 148.61 31.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.118 176.154 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 21.1 m -65.29 157.77 28.16 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.931 0.396 . . . . 0.0 111.496 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.38 -26.18 63.6 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.277 0.56 . . . . 0.0 110.85 178.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.61 15.86 13.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.254 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.594 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 16.2 t80 -71.23 -39.46 71.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.699 -178.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -35.27 65.86 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.981 -179.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.07 -48.28 58.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.931 -178.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -90.81 -42.87 10.41 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -174.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.594 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 35.9 t -82.42 -51.94 7.36 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.379 -175.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.405 ' HE3' ' HB2' ' A' ' 40' ' ' LYS . 0.4 OUTLIER 57.72 75.56 0.54 Allowed Pre-proline 0 CA--C 1.531 0.242 0 O-C-N 123.607 0.567 . . . . 0.0 111.151 176.719 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo . . . . . 0 C--N 1.348 0.507 0 C-N-CA 123.089 2.526 . . . . 0.0 112.65 179.944 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 C--O 1.236 0.359 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 2.6 t -80.33 138.18 36.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.801 0.334 . . . . 0.0 110.262 -178.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -134.28 -81.79 0.45 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.104 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -112.09 31.93 6.66 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 176.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.67 ' O ' ' HB2' ' A' ' 21' ' ' CYS . 2.9 mtt-85 -86.51 54.07 3.03 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 121.586 0.708 . . . . 0.0 109.87 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -150.64 18.64 0.81 Allowed 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 167.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.69 -36.65 0.21 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.924 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.525 ' HG2' ' HA ' ' A' ' 8' ' ' ARG . 17.2 pt-20 -68.6 -25.07 64.68 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.079 178.107 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 102.7 161.23 25.87 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.246 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.543 ' CE1' ' HG3' ' A' ' 20' ' ' GLN . 3.9 t80 -68.4 119.27 12.63 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.269 0.557 . . . . 0.0 110.607 178.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.548 ' HB3' ' HB2' ' A' ' 17' ' ' LYS . 4.2 t-20 -103.34 104.15 14.23 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.895 175.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -79.47 51.47 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 176.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -157.52 -41.99 0.07 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.671 -1.15 . . . . 0.0 109.475 -174.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.548 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -67.18 126.48 29.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.009 174.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.42 -59.26 1.63 Allowed 'General case' 0 N--CA 1.474 0.767 0 O-C-N 124.014 0.821 . . . . 0.0 113.172 -175.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -100.12 143.84 29.86 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 177.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.647 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.4 mm-40 -131.34 145.17 51.73 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.127 0.489 . . . . 0.0 112.108 -173.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.819 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 1.8 m -136.4 120.22 17.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.441 171.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.429 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 10.4 t70 -154.87 -171.49 3.85 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 172.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.04 -33.03 72.95 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 107.248 -1.389 . . . . 0.0 107.248 162.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.9 mp -77.85 14.39 1.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.557 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.429 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -65.59 -37.36 86.4 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 176.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -26.31 62.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.167 0.508 . . . . 0.0 110.582 176.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.403 ' HD2' ' CD2' ' A' ' 28' ' ' TYR . 91.7 t80 -66.34 -39.77 89.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.093 -178.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.403 ' CD2' ' HD2' ' A' ' 27' ' ' TYR . 43.6 m-85 -102.87 -8.68 20.54 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.657 0.265 . . . . 0.0 110.709 177.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 50.68 48.7 22.27 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.771 -177.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.6 m -140.22 54.34 1.63 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.51 -177.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.647 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.95 137.09 36.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.43 -178.316 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.23 151.77 43.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.943 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.9 -27.61 66.87 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -174.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.06 13.4 18.95 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.194 -176.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.819 ' CD1' ' HB3' ' A' ' 21' ' ' CYS . 3.3 t80 -63.86 -48.45 76.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.2 -178.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.07 -31.21 68.69 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.298 -177.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.58 -51.53 27.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.359 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -77.58 -49.52 14.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.983 -174.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 1.4 t -85.27 -54.49 4.57 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.85 -175.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 61.28 78.19 0.32 Allowed Pre-proline 0 C--O 1.233 0.225 0 O-C-N 123.49 0.494 . . . . 0.0 110.861 -177.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo . . . . . 0 C--N 1.347 0.455 0 C-N-CA 122.783 2.322 . . . . 0.0 112.313 179.783 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.315 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.557 ' HB2' ' HB2' ' A' ' 38' ' ' GLU . 87.0 m -65.74 153.45 41.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.432 0.634 . . . . 0.0 111.156 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.518 ' O ' ' HE3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -151.71 31.08 0.57 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.468 0.651 . . . . 0.0 109.397 175.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 80.58 33.4 31.14 Favored Glycine 0 N--CA 1.443 -0.84 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.806 -174.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -4.99 44.23 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.96 0.41 . . . . 0.0 110.288 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.598 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 35.3 m -68.7 1.74 3.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.162 177.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 p -86.26 -24.23 26.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.148 0.499 . . . . 0.0 110.319 176.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -98.76 -6.22 29.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.274 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.91 -166.76 34.13 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.316 -176.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.446 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 15.7 t80 -70.55 108.11 4.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.944 0.402 . . . . 0.0 110.822 178.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.439 HD21 ' HA ' ' A' ' 20' ' ' GLN . 0.5 OUTLIER -78.23 86.29 4.35 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.416 176.994 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.8 56.54 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.811 0.815 . . . . 0.0 109.571 177.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -155.01 -41.35 0.09 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.761 -1.109 . . . . 0.0 109.242 -176.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.549 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -76.17 173.02 11.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.846 -179.392 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.43 ' HB2' ' HE3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -85.59 -36.78 20.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.661 -174.718 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -111.5 138.73 47.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.688 174.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.536 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 18.9 mp0 -123.83 138.17 54.54 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.919 0.39 . . . . 0.0 111.195 -175.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.598 ' HB2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -139.7 117.35 11.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.138 0.494 . . . . 0.0 109.751 167.822 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.411 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 25.6 t0 -154.23 -176.57 5.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.086 -0.961 . . . . 0.0 108.691 175.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.52 -33.22 73.74 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 166.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.0 mt -75.51 14.43 0.61 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.799 178.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.436 ' HB2' ' HB3' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -61.57 -38.13 86.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.785 0.326 . . . . 0.0 110.194 -179.539 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.77 -26.52 59.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.113 178.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -64.94 -40.83 95.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.726 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -98.32 -13.35 20.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.651 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 55.56 48.88 17.76 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.477 0.656 . . . . 0.0 110.076 -174.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.427 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 27.3 m -149.3 76.85 1.34 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.945 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.536 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -120.74 150.96 40.16 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.931 176.617 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 3.5 m -70.81 144.25 50.87 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -29.55 69.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.895 0.378 . . . . 0.0 111.296 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -91.0 31.29 1.1 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.194 0.521 . . . . 0.0 110.957 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.4 ' HD1' ' HB3' ' A' ' 21' ' ' CYS . 17.8 t80 -65.52 -40.58 93.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.647 0.737 . . . . 0.0 109.652 179.204 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.446 ' HA ' ' HD2' ' A' ' 41' ' ' PRO . 0.1 OUTLIER -72.05 -34.08 68.49 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.726 179.73 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -71.12 -55.06 8.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.198 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.557 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 32.7 mt-10 -97.51 0.43 47.51 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -169.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -126.6 -36.74 2.22 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.444 173.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.24 74.87 0.51 Allowed Pre-proline 0 N--CA 1.465 0.29 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 171.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.446 ' HD2' ' HA ' ' A' ' 36' ' ' THR . 17.8 Cg_endo . . . . . 0 C--N 1.344 0.301 0 C-N-CA 122.275 1.984 . . . . 0.0 111.831 177.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.448 -0.555 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.517 ' H ' ' HB2' ' A' ' 34' ' ' ASP . 0.9 OUTLIER -84.39 154.13 23.02 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.629 -178.315 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.528 ' HG3' ' N ' ' A' ' 7' ' ' GLY . 0.0 OUTLIER -164.01 -33.77 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.91 177.388 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . 0.528 ' N ' ' HG3' ' A' ' 6' ' ' LYS . . . -154.47 63.35 0.35 Allowed Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.211 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.403 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -129.41 -37.34 1.63 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 175.623 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.4 -21.2 65.6 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.748 -178.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -85.69 -13.03 49.74 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.355 -176.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -111.16 -54.7 2.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.657 -177.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.99 -171.14 26.25 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.695 -0.765 . . . . 0.0 111.853 -179.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.705 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 3.2 t80 -83.61 112.48 20.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.921 0.391 . . . . 0.0 111.137 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.415 ' C ' ' H ' ' A' ' 16' ' ' ASP . 1.5 t30 -99.57 103.0 14.68 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 171.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.401 ' H ' HG23 ' A' ' 15' ' ' VAL . 0.2 OUTLIER -78.53 42.67 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.512 0.673 . . . . 0.0 109.962 -177.812 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -128.8 -27.66 2.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.405 -178.555 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.513 ' HB2' ' OE1' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -87.15 -165.58 1.34 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.786 -177.37 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.46 -61.88 1.47 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.186 -178.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -110.22 138.88 46.0 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.273 0.558 . . . . 0.0 109.86 176.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.643 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 4.2 mp0 -120.32 152.42 37.85 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.622 -177.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.471 ' HB3' ' CD2' ' A' ' 35' ' ' TYR . 86.2 m -123.12 113.44 18.98 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 168.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.497 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 13.1 t70 -156.66 179.04 9.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.995 178.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.46 -35.53 75.72 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 165.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.1 mt -77.11 9.38 3.07 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.654 -179.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.705 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -60.86 -41.74 96.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.169 -175.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.66 -29.89 63.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.247 -177.003 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -62.85 -48.92 76.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.782 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -84.0 -15.16 48.69 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.226 177.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.82 45.35 15.57 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.611 -178.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -138.17 63.03 1.55 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.465 -178.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.643 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -102.77 153.28 20.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.875 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.451 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 1.9 m -82.16 139.08 34.54 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 171.5 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -21.91 65.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.278 0.561 . . . . 0.0 111.474 -177.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.517 ' HB2' ' H ' ' A' ' 5' ' ' CYS . 0.7 OUTLIER -86.04 17.85 3.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.237 -175.345 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.471 ' CD2' ' HB3' ' A' ' 21' ' ' CYS . 15.0 t80 -64.53 -55.57 19.7 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.369 0.605 . . . . 0.0 110.409 -178.309 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.2 p -70.62 -29.03 65.3 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.254 -175.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -68.47 -55.08 13.01 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.892 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -91.36 -50.98 5.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.3 m -71.53 -47.27 56.27 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 121.225 -0.19 . . . . 0.0 111.055 -173.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 mtpp 59.36 77.5 0.39 Allowed Pre-proline 0 N--CA 1.464 0.231 0 O-C-N 123.409 0.443 . . . . 0.0 110.569 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo . . . . . 0 C--N 1.343 0.279 0 C-N-CA 123.313 2.675 . . . . 0.0 112.573 -175.362 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.552 ' HA ' ' HB2' ' A' ' 34' ' ' ASP . 0.8 OUTLIER . . . . . 0 N--CA 1.448 -0.527 0 CA-C-O 120.998 0.428 . . . . 0.0 110.857 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.473 ' HB3' ' HG3' ' A' ' 8' ' ' ARG . 2.8 m -77.97 119.7 21.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.904 177.356 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 mtmt -119.76 -54.77 2.13 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 176.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.88 -17.85 42.62 Favored Glycine 0 N--CA 1.44 -1.079 0 CA-C-N 115.276 -0.875 . . . . 0.0 112.349 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.473 ' HG3' ' HB3' ' A' ' 5' ' ' CYS . 0.1 OUTLIER -98.62 40.85 1.17 Allowed 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 122.025 -0.691 . . . . 0.0 110.501 -173.456 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.636 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.8 OUTLIER -131.44 -7.29 3.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.455 177.007 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.39 2.47 8.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.72 -174.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -104.68 12.21 33.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.225 0.536 . . . . 0.0 110.389 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 86.75 -173.29 45.2 Favored Glycine 0 N--CA 1.442 -0.953 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.601 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 7.9 t80 -93.73 107.13 19.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.691 0.282 . . . . 0.0 110.439 -178.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.36 95.25 8.68 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.851 173.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.452 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -80.78 41.32 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.522 0.677 . . . . 0.0 110.115 -178.314 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -134.31 -13.26 2.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.051 -178.335 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 13.9 mmtm -91.85 179.3 5.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.143 0.497 . . . . 0.0 111.904 -170.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.92 -29.88 28.86 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.622 -178.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -140.01 149.45 43.23 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.601 ' HG2' ' CE1' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -130.73 146.09 52.11 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.999 -174.265 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.636 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 4.1 m -143.88 117.79 9.38 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 169.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.591 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 17.6 t70 -154.64 -179.35 7.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -69.12 -29.48 67.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 166.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 50.5 mt -79.56 14.42 1.65 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.167 176.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.591 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -63.28 -39.32 94.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.706 -0.225 . . . . 0.0 110.548 -179.867 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.95 -28.27 61.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.131 -179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -64.15 -52.32 59.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.664 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -85.18 -16.17 41.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.927 -179.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.0 44.64 22.52 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.98 -179.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.6 m -141.77 56.74 1.5 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.192 -177.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.549 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.1 OUTLIER -108.76 146.03 34.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.663 179.131 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 m -69.55 156.88 38.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.891 179.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -28.57 69.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.968 0.413 . . . . 0.0 111.989 -177.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.552 ' HB2' ' HA ' ' A' ' 4' ' ' SER . 2.5 m-20 -85.25 13.97 5.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.293 -175.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.46 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 46.3 t80 -66.72 -50.5 62.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.094 0.473 . . . . 0.0 110.637 -177.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.477 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -70.63 -28.61 64.95 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.104 -178.224 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.52 -52.75 50.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.969 178.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -89.63 -53.74 4.39 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -71.01 -44.37 66.01 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.696 -172.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' A' ' 36' ' ' THR . 0.2 OUTLIER 58.07 85.1 0.19 Allowed Pre-proline 0 N--CA 1.465 0.323 0 O-C-N 123.712 0.632 . . . . 0.0 112.088 176.861 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.463 -0.267 0 C-N-CA 122.474 2.116 . . . . 0.0 111.501 176.479 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 74.0 m . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 120.814 0.34 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.635 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 44.4 t -83.05 149.87 26.67 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.358 -178.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -162.48 -64.26 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 123.555 0.535 . . . . 0.0 110.179 173.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.81 34.16 4.8 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.422 -173.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.477 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 2.2 mmp_? -98.97 -32.95 11.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.419 0.61 . . . . 0.0 110.149 175.032 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.465 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 1.0 OUTLIER -68.55 -21.69 64.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.416 -175.021 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.58 -27.52 45.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.265 -177.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.95 -50.31 4.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.891 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 135.77 -156.97 23.09 Favored Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 111.296 -0.722 . . . . 0.0 111.296 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.57 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 3.9 t80 -84.29 107.83 16.8 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.132 0.491 . . . . 0.0 110.915 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.415 ' C ' ' H ' ' A' ' 16' ' ' ASP . 0.2 OUTLIER -89.63 93.04 9.32 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.589 173.507 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.419 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -78.47 35.97 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.131 0.491 . . . . 0.0 110.885 -176.634 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.2 OUTLIER -133.37 2.3 3.53 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.114 177.569 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.5 mmpp? -109.08 -169.52 1.5 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.311 -178.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.17 -63.79 1.11 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.452 -178.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.08 138.57 35.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.941 177.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.57 ' HG2' ' CE1' ' A' ' 13' ' ' PHE . 2.3 mp0 -129.08 145.61 51.23 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.271 -174.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.2 m -135.57 116.36 14.03 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 168.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -155.04 179.16 9.41 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.449 -0.796 . . . . 0.0 108.994 174.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.58 -22.07 63.56 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 167.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.6 mt -81.24 10.9 4.78 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.367 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -38.13 86.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.739 0.305 . . . . 0.0 110.567 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -26.8 65.65 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.403 179.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -77.81 -52.37 9.0 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.377 -176.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.405 ' HB2' ' CZ ' ' A' ' 13' ' ' PHE . 50.5 m-85 -88.25 -16.69 32.52 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.347 -177.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 72.8 mm-40 53.89 54.45 9.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.308 0.575 . . . . 0.0 111.028 -177.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.34 39.51 3.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.766 -178.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -98.53 147.58 24.62 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.226 -177.25 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.635 ' SG ' ' HB2' ' A' ' 5' ' ' CYS . 1.9 m -77.98 164.13 25.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.164 178.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.62 -38.11 86.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.931 -177.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.43 32.88 1.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.21 0.529 . . . . 0.0 110.929 -178.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.465 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 16.8 t80 -72.17 -41.75 66.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.5 0.667 . . . . 0.0 109.676 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -30.09 70.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.236 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.21 -54.63 11.99 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.258 177.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.618 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 46.3 mm-40 -68.73 -53.13 23.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.829 -175.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.519 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 0.5 OUTLIER -73.15 -48.79 32.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.524 -177.805 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.68 61.33 12.6 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.935 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.519 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 64.8 Cg_endo . . . . . 0 N--CA 1.458 -0.603 0 C-N-CA 121.902 1.735 . . . . 0.0 111.526 177.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.521 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.494 ' HB3' ' HG2' ' A' ' 38' ' ' GLU . 30.0 m -112.13 122.07 46.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 176.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.454 ' HE2' ' O ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -146.58 28.91 1.05 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.063 0.459 . . . . 0.0 110.567 -178.501 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 141.97 26.28 0.18 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.799 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.43 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.2 OUTLIER -82.37 -27.38 32.15 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.494 ' HB2' ' OE1' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -70.1 -18.49 63.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.27 0.557 . . . . 0.0 110.208 -179.921 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -107.48 -11.38 15.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.355 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.92 -16.94 14.71 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.067 0.461 . . . . 0.0 110.683 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 112.67 146.05 9.75 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.812 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.561 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 10.0 t80 -56.22 107.36 0.36 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.454 0.645 . . . . 0.0 110.655 178.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.534 HD21 ' HA ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -83.66 81.92 8.54 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.45 179.307 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.415 HG23 ' H ' ' A' ' 15' ' ' VAL . 0.0 OUTLIER -69.97 -1.18 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.053 0.454 . . . . 0.0 110.412 -178.672 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.56 -9.28 25.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.193 179.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.409 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -96.63 -176.63 3.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.795 0.331 . . . . 0.0 111.344 -176.084 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -82.03 -56.09 4.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.649 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.43 138.23 48.19 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.616 -0.512 . . . . 0.0 109.616 176.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.652 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -127.82 149.63 50.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.278 -171.942 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 53.8 m -144.92 119.37 9.65 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.343 174.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.491 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 6.8 t0 -153.1 -174.8 5.07 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 169.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -68.29 -21.89 64.76 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 170.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -86.41 14.47 6.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.99 177.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.561 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -59.41 -40.96 88.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.611 178.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -26.03 60.64 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.004 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -66.21 -45.64 80.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.63 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -90.91 -17.0 27.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.769 0.319 . . . . 0.0 110.745 178.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 52.81 50.36 18.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.573 -174.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -142.04 48.24 1.6 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.079 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.652 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.64 146.77 24.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.799 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.23 160.77 27.74 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.397 177.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -29.5 70.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.938 -178.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -85.82 28.25 0.8 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.749 0.309 . . . . 0.0 111.234 -179.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -70.51 -47.58 59.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.459 0.647 . . . . 0.0 110.082 -178.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -28.88 66.42 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.997 -178.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.98 -48.96 74.35 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.747 178.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.494 ' HG2' ' HB3' ' A' ' 5' ' ' CYS . 0.3 OUTLIER -87.58 -40.39 14.27 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.484 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.43 ' N ' ' HG3' ' A' ' 38' ' ' GLU . 49.1 t -91.81 -55.57 3.42 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.333 -175.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 tttt 47.85 67.41 4.51 Favored Pre-proline 0 N--CA 1.465 0.299 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.119 -173.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo . . . . . 0 C--N 1.343 0.271 0 C-N-CA 122.579 2.186 . . . . 0.0 111.515 179.952 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 121.197 0.522 . . . . 0.0 110.836 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 3.5 t -82.93 118.6 23.58 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.418 -176.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.438 ' HE2' ' O ' ' A' ' 5' ' ' CYS . 13.5 mmtt -141.63 -60.98 0.47 Allowed 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 175.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -128.32 51.68 0.85 Allowed Glycine 0 N--CA 1.444 -0.794 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.851 176.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.53 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -91.71 -21.1 20.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.113 0.482 . . . . 0.0 109.761 177.004 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -76.54 -18.12 58.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.76 -176.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.76 -21.16 41.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.765 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.6 -42.22 6.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.18 -179.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 122.1 179.54 15.97 Favored Glycine 0 N--CA 1.444 -0.768 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 -177.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.713 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 6.6 t80 -62.36 107.11 0.85 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.185 0.517 . . . . 0.0 110.635 177.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.426 ' ND2' ' HB2' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -89.3 84.59 6.48 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.852 176.161 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.462 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -68.45 -14.48 18.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.2 0.524 . . . . 0.0 109.902 -177.955 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -21.44 54.81 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.224 177.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.426 ' HB2' ' ND2' ' A' ' 14' ' ' ASN . 1.7 mmpp? -84.02 171.2 13.16 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.14 -9.87 37.9 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.117 0.484 . . . . 0.0 110.36 -179.011 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -137.2 138.2 39.93 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 172.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.576 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 26.7 mp0 -131.8 148.03 52.53 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.844 0.354 . . . . 0.0 111.86 -169.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.53 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 64.8 m -142.34 118.26 10.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.725 170.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -153.3 -173.7 4.67 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 167.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -19.46 63.74 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 169.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 mt -88.44 14.62 9.3 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.252 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.713 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -60.73 -37.38 81.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.68 0.276 . . . . 0.0 110.776 -178.578 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -26.7 60.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.245 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -68.46 -44.07 75.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.582 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -88.43 -15.75 34.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.406 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 56.8 49.5 14.14 Favored 'General case' 0 CA--C 1.522 -0.1 0 O-C-N 123.713 0.633 . . . . 0.0 110.152 -176.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.2 m -151.39 76.47 1.22 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.224 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -118.67 151.5 37.84 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.994 176.179 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 3.3 m -80.11 160.12 25.85 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.91 0.386 . . . . 0.0 110.967 177.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -26.92 68.89 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.142 0.496 . . . . 0.0 111.317 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.61 7.34 36.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.486 -177.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.468 ' CD1' ' HB3' ' A' ' 21' ' ' CYS . 13.5 t80 -62.59 -47.18 84.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.323 0.582 . . . . 0.0 110.123 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -32.97 63.94 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.057 -178.316 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.89 -50.45 34.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.036 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -93.1 -35.63 13.1 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -172.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 69.6 m -97.03 -55.17 2.95 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.428 -177.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 64.95 102.85 0.03 OUTLIER Pre-proline 0 C--O 1.232 0.153 0 O-C-N 123.612 0.57 . . . . 0.0 110.868 179.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo . . . . . 0 C--O 1.232 0.188 0 C-N-CA 123.071 2.514 . . . . 0.0 111.998 179.622 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.519 0 CA-C-O 121.387 0.613 . . . . 0.0 111.944 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.406 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 6.1 t -92.49 142.55 27.29 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.687 175.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.423 ' HB2' ' HE2' ' A' ' 6' ' ' LYS . 12.6 mtmm -118.82 -78.02 0.58 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.901 0.382 . . . . 0.0 110.328 178.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -143.19 31.63 1.94 Allowed Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.512 -0.851 . . . . 0.0 111.884 -176.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -82.33 8.95 9.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.867 0.365 . . . . 0.0 111.188 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.478 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 25.9 m -74.66 -16.69 60.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.44 0.638 . . . . 0.0 109.563 176.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -110.1 10.8 23.96 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.286 -177.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -110.45 11.92 23.07 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.697 0.761 . . . . 0.0 109.439 175.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.93 161.4 32.22 Favored Glycine 0 N--CA 1.445 -0.764 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.2 -177.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -73.56 107.2 5.69 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.287 175.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.478 HD21 ' HA ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -83.81 112.18 19.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.023 178.363 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -90.57 3.51 6.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.023 0.44 . . . . 0.0 110.555 -177.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -138.73 53.45 1.77 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.233 0.54 . . . . 0.0 110.88 177.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.445 ' CG ' ' HB2' ' A' ' 14' ' ' ASN . 6.8 mmmm -129.51 -171.3 2.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.8 172.4 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.2 -58.42 4.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.27 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -132.05 153.41 50.45 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.515 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.523 ' HG2' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -126.7 141.7 51.76 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -171.899 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.478 ' HB3' ' SG ' ' A' ' 9' ' ' CYS . 92.7 m -139.15 119.3 13.56 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.875 0.369 . . . . 0.0 110.986 174.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 19.2 t70 -153.93 -172.96 4.39 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 168.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.37 -23.8 63.79 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 167.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.1 mt -80.5 8.92 6.72 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.346 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.442 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -61.13 -39.1 88.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.879 0.371 . . . . 0.0 110.066 179.367 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.85 -26.66 62.45 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.104 178.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -66.85 -42.09 86.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.68 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -96.1 -17.5 20.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.03 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 55.47 47.06 21.87 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.101 0.477 . . . . 0.0 110.941 -175.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.523 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 0.3 OUTLIER -141.94 46.73 1.65 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.183 -178.197 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -95.29 153.71 17.54 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.593 179.815 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.42 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -66.62 156.41 35.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.582 179.08 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -37.71 75.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -172.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.425 ' HB2' ' HB3' ' A' ' 37' ' ' ALA . 9.8 p30 -103.39 31.74 4.18 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.982 0.42 . . . . 0.0 110.979 -175.358 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.603 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 7.9 t80 -62.59 -42.88 99.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.492 0.663 . . . . 0.0 109.265 178.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.541 ' O ' ' HD3' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -73.35 -32.4 64.51 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.85 179.724 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.425 ' HB3' ' HB2' ' A' ' 34' ' ' ASP . . . -66.61 -57.62 6.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.527 -178.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -87.17 -41.9 13.4 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.603 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 52.0 t -78.94 -46.8 17.61 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.401 -175.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.541 ' HD3' ' O ' ' A' ' 36' ' ' THR . 0.3 OUTLIER 55.3 75.4 0.6 Allowed Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.891 177.206 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo . . . . . 0 C--N 1.344 0.337 0 C-N-CA 123.451 2.767 . . . . 0.0 112.545 -178.672 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.45 -0.472 0 CA-C-O 121.723 0.773 . . . . 0.0 112.268 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 38.5 t -91.28 125.17 35.96 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.189 177.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.78 4.98 43.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.266 0.555 . . . . 0.0 110.021 177.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . 0.601 ' HA2' ' SG ' ' A' ' 39' ' ' CYS . . . 114.71 55.84 0.38 Allowed Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.561 -174.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.666 ' HG3' ' SG ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -84.08 7.14 19.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.469 0.652 . . . . 0.0 109.953 -178.908 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.477 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 16.4 m -72.34 -3.79 25.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.348 176.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 15.7 p -79.77 -24.61 41.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.474 0.654 . . . . 0.0 109.715 172.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -95.57 -22.8 17.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.493 -177.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.72 177.0 45.46 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 -176.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.696 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 4.0 t80 -72.87 108.39 5.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.145 0.497 . . . . 0.0 110.741 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.538 ' HB3' ' HB2' ' A' ' 17' ' ' LYS . 7.6 t-20 -96.74 106.97 19.35 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 172.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -75.49 -3.77 5.26 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -94.11 -6.86 44.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.752 176.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.538 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -94.69 159.95 14.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.843 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.585 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -84.53 -34.24 23.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.774 0.321 . . . . 0.0 110.567 -174.85 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -120.0 138.44 53.49 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 171.218 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.584 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 22.1 mp0 -127.01 140.89 51.97 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.735 -173.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.666 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -135.1 115.59 13.61 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.171 167.429 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.602 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 24.8 t70 -155.78 179.35 9.28 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.031 173.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -68.63 -26.76 65.51 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 168.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mt -76.95 5.89 7.18 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.466 177.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.696 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -61.34 -38.44 86.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.828 0.346 . . . . 0.0 110.547 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.99 -27.51 64.76 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.914 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -70.7 -46.87 62.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.903 -178.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -88.21 -12.79 42.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.658 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 55.17 47.67 21.21 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 121.639 0.733 . . . . 0.0 109.643 -174.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 16.5 m -145.12 77.76 1.53 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.189 -177.192 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.584 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -126.8 151.18 48.63 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.333 175.378 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.6 m -73.85 141.43 46.13 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 172.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -31.59 64.08 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -174.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.42 21.93 1.36 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.444 -177.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.477 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 19.2 t80 -67.99 -49.37 62.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.301 0.572 . . . . 0.0 110.324 -177.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.433 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 0.3 OUTLIER -73.6 -29.98 62.72 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.648 -176.427 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.87 -45.79 66.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.517 177.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -89.02 -53.91 4.37 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -174.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.601 ' SG ' ' HA2' ' A' ' 7' ' ' GLY . 1.4 m -76.2 -40.21 52.84 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.365 -175.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.76 92.05 0.07 OUTLIER Pre-proline 0 N--CA 1.464 0.237 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.386 175.258 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 36' ' ' THR . 2.4 Cg_endo . . . . . 0 N--CA 1.458 -0.611 0 C-N-CA 123.028 2.486 . . . . 0.0 111.365 175.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.328 0 CA-C-O 121.016 0.436 . . . . 0.0 111.649 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.792 ' SG ' ' HB2' ' A' ' 32' ' ' CYS . 84.0 m -97.55 162.83 13.11 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 168.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.48 -101.3 0.09 Allowed 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.851 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -96.13 4.79 65.33 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.217 -0.753 . . . . 0.0 111.217 -177.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.489 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 5.5 ptt-85 -79.61 66.77 5.18 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 122.063 0.935 . . . . 0.0 108.988 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.465 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -148.11 10.87 0.91 Allowed 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.744 166.685 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -145.9 9.93 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.59 177.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.424 ' HG3' ' HA ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -104.87 -27.49 11.69 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.75 -175.838 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 119.2 145.49 7.65 Favored Glycine 0 N--CA 1.444 -0.832 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 -173.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.67 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 12.9 t80 -69.91 107.37 3.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 121.312 0.577 . . . . 0.0 110.716 -174.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -84.55 97.62 9.68 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.421 174.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.654 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -87.32 28.83 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.216 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -135.87 19.58 3.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.515 -175.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.89 -176.1 2.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.605 179.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.93 -60.39 2.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.4 t -100.26 138.88 36.73 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 172.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.575 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.1 mp0 -108.6 135.35 50.0 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.923 0.392 . . . . 0.0 110.279 -175.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.516 ' SG ' ' HD1' ' A' ' 35' ' ' TYR . 0.8 OUTLIER -156.3 122.23 4.94 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.946 175.127 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.465 ' HA ' ' HA ' ' A' ' 9' ' ' CYS . 3.4 t70 -155.83 -169.03 2.96 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 160.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -14.53 62.96 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.181 0.515 . . . . 0.0 110.154 174.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.78 12.38 30.22 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.227 179.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.67 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -54.57 -40.45 68.79 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.634 0.254 . . . . 0.0 111.309 178.861 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -37.38 78.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.917 0.389 . . . . 0.0 111.028 -179.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -62.54 -48.31 80.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.679 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -81.83 -15.7 53.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.108 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 56.09 47.65 19.21 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.506 0.669 . . . . 0.0 110.334 -176.609 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.0 m -150.68 77.21 1.28 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.971 -177.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.575 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -125.9 157.26 38.15 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.27 174.994 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.792 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 2.6 m -71.02 158.84 35.81 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 174.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.12 -29.69 69.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.965 -173.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -94.38 32.97 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.483 0.658 . . . . 0.0 111.047 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.516 ' HD1' ' SG ' ' A' ' 21' ' ' CYS . 45.6 t80 -62.18 -38.72 90.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.583 179.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.535 ' O ' ' HA ' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -69.96 -29.01 66.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.986 -179.814 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.72 -45.73 67.54 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.143 0.497 . . . . 0.0 111.006 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -82.11 -51.33 8.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.084 -175.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.6 t -75.65 -41.35 54.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.912 0.387 . . . . 0.0 110.206 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.535 ' HA ' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 63.19 66.59 1.16 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.277 -0.874 . . . . 0.0 113.038 175.875 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo . . . . . 0 N--CA 1.455 -0.764 0 C-N-CA 122.205 1.937 . . . . 0.0 110.617 170.176 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.442 -0.857 0 CA-C-O 121.03 0.443 . . . . 0.0 110.074 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.448 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -64.94 120.84 13.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.739 -178.975 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.66 -70.7 0.76 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 173.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.26 61.15 0.63 Allowed Glycine 0 N--CA 1.439 -1.113 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.364 177.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.8 ptp180 -130.62 8.27 4.92 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.837 0.351 . . . . 0.0 110.176 175.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.735 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 83.5 m -103.18 19.55 19.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.634 0.731 . . . . 0.0 109.486 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.84 -46.7 1.97 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.069 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.54 -54.18 46.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.84 174.08 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 149.88 175.39 22.04 Favored Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 121.058 -0.592 . . . . 0.0 111.765 -179.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.581 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 30.0 t80 -65.81 113.91 4.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.163 0.506 . . . . 0.0 111.185 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.662 HD21 ' HA ' ' A' ' 20' ' ' GLN . 0.7 OUTLIER -81.89 116.04 21.36 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.667 172.125 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.401 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.2 OUTLIER -97.85 -11.34 8.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-O 121.439 0.637 . . . . 0.0 109.398 177.324 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -33.92 37.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.38 179.184 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 3.1 mmtm -70.69 -178.64 1.9 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.167 0.508 . . . . 0.0 111.96 -174.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.82 -47.25 7.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.725 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -109.55 139.49 44.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.491 174.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.699 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -123.2 142.16 51.2 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 120.826 0.346 . . . . 0.0 111.385 -174.089 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.735 ' HB3' ' SG ' ' A' ' 9' ' ' CYS . 1.3 m -145.82 115.9 7.42 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.048 172.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.619 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 21.3 t70 -156.39 -176.95 6.24 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.6 -33.92 75.97 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 166.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.63 5.24 3.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.884 178.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.619 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -64.33 -33.63 76.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 -179.631 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.09 -25.92 64.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.783 178.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -73.19 -34.18 65.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.942 -178.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -102.9 -16.39 15.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.673 0.273 . . . . 0.0 111.134 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 59.11 36.47 24.13 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.397 -178.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -133.07 51.84 2.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.404 -177.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.699 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -97.51 148.27 23.41 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.338 177.902 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.441 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 1.8 m -74.53 162.22 29.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.658 178.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.46 -25.19 67.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.929 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.37 12.06 9.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.66 -176.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.435 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 31.0 t80 -63.53 -50.28 70.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.558 0.694 . . . . 0.0 110.754 -176.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -29.52 62.17 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.326 -176.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.69 -54.51 18.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.089 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -84.06 -53.27 5.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 0.0 112.034 -174.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.8 m -77.7 -47.95 17.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.182 -171.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.94 73.09 0.89 Allowed Pre-proline 0 N--CA 1.465 0.316 0 O-C-N 123.541 0.525 . . . . 0.0 111.395 178.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo . . . . . 0 C--N 1.343 0.28 0 C-N-CA 122.561 2.174 . . . . 0.0 112.223 -179.135 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.35 0 CA-C-O 120.952 0.406 . . . . 0.0 111.2 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.458 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 4.7 t -99.34 169.3 9.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.365 178.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.544 ' HG3' ' N ' ' A' ' 7' ' ' GLY . 0.5 OUTLIER 176.96 -36.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.844 175.149 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . 0.544 ' N ' ' HG3' ' A' ' 6' ' ' LYS . . . -147.89 62.27 0.44 Allowed Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.832 -0.699 . . . . 0.0 111.955 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.613 ' HG3' ' SG ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -120.91 -40.14 2.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.99 0.424 . . . . 0.0 110.022 174.253 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 33.4 m -64.26 -19.66 65.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.256 0.551 . . . . 0.0 110.4 179.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -81.27 -15.08 56.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.64 -178.004 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.403 ' H ' ' HG2' ' A' ' 11' ' ' GLU . 0.1 OUTLIER -121.93 -4.75 9.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.738 -176.533 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.7 -175.16 51.98 Favored Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 111.321 -0.712 . . . . 0.0 111.321 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -69.4 109.74 4.34 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.224 0.535 . . . . 0.0 111.619 -177.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -92.21 102.07 14.58 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.088 169.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -78.32 47.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.962 0.886 . . . . 0.0 109.968 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -138.09 -35.42 0.63 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.771 -179.108 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.518 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -71.13 166.93 20.39 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.652 -174.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.3 -37.13 16.24 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.861 -175.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -103.98 137.63 41.68 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 172.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.543 ' HB2' ' O ' ' A' ' 30' ' ' SER . 24.2 mp0 -121.63 121.79 38.16 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.243 -173.5 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.613 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -139.57 115.45 10.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.993 0.425 . . . . 0.0 110.116 170.599 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -155.99 -175.17 5.29 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -68.75 -32.36 72.07 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 165.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.7 mt -78.68 7.39 6.96 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.816 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.17 -33.8 76.88 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -26.86 62.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.588 178.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.423 ' HD2' ' CE1' ' A' ' 28' ' ' TYR . 35.7 t80 -67.97 -43.8 78.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.607 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.423 ' CE1' ' HD2' ' A' ' 27' ' ' TYR . 93.8 m-85 -86.29 -16.06 38.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.848 0.356 . . . . 0.0 110.551 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 60.82 38.58 17.88 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.603 -178.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.543 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 5.7 m -145.5 72.85 1.33 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.316 -177.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -101.09 156.94 17.12 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.164 177.161 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 58.7 m -62.88 144.94 56.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.549 175.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.91 -26.98 67.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.184 178.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.05 26.57 7.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.76 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.494 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 11.6 t80 -65.93 -38.34 88.41 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.509 0.671 . . . . 0.0 109.633 -177.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.15 -33.77 63.63 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.184 178.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.61 -50.17 39.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.84 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -87.81 -45.97 9.85 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.149 -173.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.494 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 35.3 t -88.28 -37.08 16.32 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.915 -0.314 . . . . 0.0 111.06 -173.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt 62.46 84.6 0.19 Allowed Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 112.659 0.615 . . . . 0.0 112.659 172.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo . . . . . 0 CA--C 1.534 0.525 0 C-N-CA 123.134 2.556 . . . . 0.0 112.385 175.458 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 11.7 t70 . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.679 0.276 . . . . 0.0 110.683 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 15.2 mp0 -77.54 51.99 0.94 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.223 0.535 . . . . 0.0 111.823 -174.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.449 ' HB3' ' HD3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -114.64 16.6 17.5 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 174.147 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.69 164.51 9.7 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.481 -178.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.493 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 1.2 m -91.99 128.3 37.78 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-O 120.959 0.409 . . . . 0.0 111.356 -178.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.93 -99.02 0.34 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.884 175.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.68 6.84 74.23 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.948 -177.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.533 ' HA ' ' OE1' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -85.94 45.54 1.23 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.147 0.498 . . . . 0.0 110.078 -176.423 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.3 t -133.76 17.06 3.91 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.603 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.73 -38.01 2.42 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.588 -176.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.533 ' OE1' ' HA ' ' A' ' 8' ' ' ARG . 2.4 pm0 -72.92 -26.58 61.45 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.818 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 126.59 175.07 14.01 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.654 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.41 ' HD2' ' HB3' ' A' ' 22' ' ' ASP . 18.5 t80 -68.5 116.04 8.6 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.9 0.381 . . . . 0.0 111.334 -176.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.47 97.84 6.57 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 170.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -80.07 -2.86 5.77 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-O 121.304 0.573 . . . . 0.0 109.644 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -119.79 46.79 1.86 Allowed 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.384 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.58 172.11 12.29 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 171.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.449 ' HD3' ' HB3' ' A' ' 3' ' ' GLU . 0.0 OUTLIER -80.13 -21.79 42.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.225 0.536 . . . . 0.0 110.171 178.974 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 t -149.18 138.48 21.54 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.027 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.575 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -130.68 151.98 50.53 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -168.151 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.5 m -142.46 120.13 11.83 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.573 172.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.538 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 28.7 t0 -154.31 -179.54 8.03 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 170.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.62 -22.54 65.33 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 167.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.6 mt -85.53 14.21 5.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.119 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.538 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -61.23 -39.3 89.8 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 178.707 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.29 -25.96 59.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.799 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -67.5 -47.83 68.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.731 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -90.04 -16.06 30.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.641 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 58.86 50.53 8.43 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.423 0.63 . . . . 0.0 110.085 -173.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -147.92 78.22 1.44 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.506 -177.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.575 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.1 OUTLIER -127.73 147.42 50.4 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.325 175.162 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 5' ' ' CYS . 4.1 m -73.84 169.42 17.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.156 0.503 . . . . 0.0 111.741 178.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.65 -28.27 64.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.471 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.493 ' OD1' ' HB2' ' A' ' 5' ' ' CYS . 0.4 OUTLIER -89.56 17.05 6.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.763 0.316 . . . . 0.0 110.772 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -67.11 -48.03 69.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.564 0.697 . . . . 0.0 109.579 178.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -29.72 64.22 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.752 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.99 -57.79 4.59 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.388 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 24.5 mm-40 -78.96 -42.6 26.41 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -173.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.1 t -84.12 -55.4 4.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.363 -174.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 mttt 61.52 76.16 0.41 Allowed Pre-proline 0 N--CA 1.467 0.408 0 CA-C-O 121.103 0.478 . . . . 0.0 110.429 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -75.02 -12.04 21.46 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.67 2.246 . . . . 0.0 113.402 -174.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 64.46 71.19 0.48 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.004 0.43 . . . . 0.0 110.729 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.58 HG12 ' HA2' ' A' ' 46' ' ' GLY . 2.6 t -79.08 86.33 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 120.989 0.424 . . . . 0.0 110.779 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -77.21 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.882 -177.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.21 -12.31 59.65 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.533 -174.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.58 ' HA2' HG12 ' A' ' 43' ' ' VAL . . . 76.91 -90.12 0.97 Allowed Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.479 -0.867 . . . . 0.0 111.464 -175.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.0 t70 . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.228 -0.892 . . . . 0.0 109.384 176.45 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -99.06 105.85 18.02 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 174.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.452 ' OE1' ' HD3' ' A' ' 18' ' ' LYS . 7.8 mm-40 -86.61 114.32 23.23 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.264 0.554 . . . . 0.0 111.41 -174.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.84 142.53 50.39 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.469 175.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.638 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -86.27 121.69 29.2 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.804 -178.065 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -151.51 -88.32 0.06 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.461 -0.791 . . . . 0.0 108.999 176.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.46 34.43 2.9 Favored Glycine 0 N--CA 1.451 -0.366 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.136 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.495 ' HD2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -128.13 10.54 6.38 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.831 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.634 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 4.0 t -115.0 -11.29 12.15 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 173.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.88 -6.06 20.53 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.191 -177.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.489 ' HG2' ' HA ' ' A' ' 8' ' ' ARG . 22.0 pt-20 -105.05 -14.56 15.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.988 -177.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.21 149.94 25.86 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.915 -176.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.445 ' CE2' ' HG2' ' A' ' 20' ' ' GLN . 2.6 t80 -56.94 109.12 0.59 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.11 0.481 . . . . 0.0 111.869 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.461 ' C ' ' H ' ' A' ' 16' ' ' ASP . 54.7 t30 -99.98 113.46 26.05 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 170.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.2 t -78.83 39.08 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.818 0.818 . . . . 0.0 110.509 -177.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.461 ' H ' ' C ' ' A' ' 14' ' ' ASN . 24.5 t0 -151.35 29.19 0.63 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.036 173.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.617 ' HB2' HE22 ' A' ' 20' ' ' GLN . 7.0 mmtp -110.09 155.06 22.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.468 175.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.452 ' HD3' ' OE1' ' A' ' 3' ' ' GLU . 0.0 OUTLIER -64.13 -74.09 0.11 Allowed 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.324 0.39 . . . . 0.0 111.032 178.846 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -102.4 154.97 18.57 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 174.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.617 HE22 ' HB2' ' A' ' 17' ' ' LYS . 1.1 tp-100 -138.62 146.71 42.05 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -171.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.634 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 39.8 m -140.56 117.69 11.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.21 -0.904 . . . . 0.0 108.866 168.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.534 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 10.7 t70 -154.76 179.4 9.12 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -69.38 -35.11 75.48 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 165.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 40.7 mt -74.93 2.29 10.73 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.393 178.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.534 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -63.72 -33.74 76.32 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 178.218 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -36.12 63.09 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.128 0.489 . . . . 0.0 110.488 176.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -62.76 -46.45 87.98 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.431 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -89.44 -8.74 52.37 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.338 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 52.91 47.22 25.15 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.201 0.524 . . . . 0.0 111.473 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.4 m -148.06 73.41 1.26 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.604 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -120.15 152.08 38.16 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.852 0.358 . . . . 0.0 110.883 177.216 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.489 ' SG ' ' SG ' ' A' ' 5' ' ' CYS . 1.6 m -76.34 159.06 30.88 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.101 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -25.87 67.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.012 0.434 . . . . 0.0 111.515 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.2 15.62 4.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.798 -177.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.447 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 23.3 t80 -65.79 -50.8 63.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.425 0.631 . . . . 0.0 110.162 -177.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.13 -29.5 62.94 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.048 -176.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.86 -49.91 59.47 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.212 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.638 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 31.1 mm-40 -84.35 -51.38 7.01 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.26 -0.427 . . . . 0.0 112.15 -174.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.09 -42.55 23.41 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.852 -175.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.18 56.32 14.1 Favored Pre-proline 0 N--CA 1.469 0.475 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 177.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -85.65 -15.76 4.89 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.22 1.946 . . . . 0.0 112.726 -178.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -105.41 100.55 10.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.035 0.445 . . . . 0.0 110.377 -177.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 t -76.18 109.77 10.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.431 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.19 94.3 2.94 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.371 -178.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -71.69 0.32 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.14 176.145 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 104.85 120.53 4.77 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.599 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 t70 . . . . . 0 C--O 1.246 0.909 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.132 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 34.0 p-10 . . . . . 0 N--CA 1.481 1.12 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -158.85 18.04 0.19 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.987 0.422 . . . . 0.0 110.868 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -74.85 83.99 2.18 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.282 -176.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m -73.86 132.54 42.63 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.621 176.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.598 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -71.09 149.52 46.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.635 -175.387 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -144.48 -104.42 0.11 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.138 173.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -89.72 37.5 3.34 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.961 -0.638 . . . . 0.0 113.438 -173.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.554 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -74.18 -26.39 60.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.003 0.43 . . . . 0.0 110.025 177.54 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.412 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 0.8 OUTLIER -72.71 -23.85 60.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.754 -174.676 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.64 -36.13 16.43 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.906 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -71.36 -43.33 67.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.274 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 119.65 175.03 15.76 Favored Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 111.364 -0.694 . . . . 0.0 111.364 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.425 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 4.2 t80 -76.02 107.63 8.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.166 0.508 . . . . 0.0 110.515 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -93.23 100.79 13.09 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.737 174.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.3 t -77.44 52.23 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.853 0.835 . . . . 0.0 110.457 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -151.67 -30.66 0.16 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.188 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.553 ' HB2' HE22 ' A' ' 20' ' ' GLN . 0.1 OUTLIER -77.02 163.43 26.69 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.17 176.278 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -77.61 -62.9 1.51 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.245 -171.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.74 138.61 34.04 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.579 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -130.86 142.91 50.41 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.703 -173.086 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.554 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 92.6 m -135.72 118.01 15.62 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 170.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.468 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 14.9 t70 -153.77 178.54 9.77 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 177.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.81 -25.87 63.98 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 166.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.446 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 0.3 OUTLIER -80.74 14.32 2.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.511 176.205 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.468 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -63.46 -47.52 81.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.551 -178.739 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.72 -25.61 66.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.224 0.535 . . . . 0.0 110.928 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.446 ' HB3' ' O ' ' A' ' 24' ' ' LEU . 78.0 t80 -63.29 -39.03 93.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.784 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -105.01 -16.44 14.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.414 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 58.1 38.78 26.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.284 0.564 . . . . 0.0 110.717 -177.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.4 m -127.57 41.47 3.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.761 -177.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.88 150.1 21.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.624 -179.538 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.0 m -73.24 154.11 40.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.333 177.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.87 -37.45 79.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.92 0.391 . . . . 0.0 111.773 -178.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.14 40.22 1.04 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.593 0.711 . . . . 0.0 110.889 -179.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.422 ' HD1' ' SG ' ' A' ' 21' ' ' CYS . 19.8 t80 -70.87 -42.78 69.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.688 178.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -31.8 72.97 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.354 -178.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.88 -43.56 79.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.804 -178.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.598 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 63.7 mm-40 -95.0 -37.59 11.06 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -173.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.9 t -82.38 -48.86 10.65 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.367 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 47.93 62.86 11.26 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.102 -177.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -74.72 6.71 3.11 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.694 2.263 . . . . 0.0 113.299 -171.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 64.44 79.49 0.25 Allowed 'General case' 0 C--O 1.235 0.334 0 O-C-N 123.468 0.48 . . . . 0.0 110.717 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 87.9 t -70.72 111.0 4.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.67 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.57 144.34 35.82 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.886 -174.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -119.83 133.01 55.74 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 173.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -59.42 -60.55 8.59 Favored Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.003 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.8 t70 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.434 -0.793 . . . . 0.0 109.95 176.938 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 121.371 0.605 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -148.01 23.68 1.07 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.611 -178.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.455 ' HA ' ' CB ' ' A' ' 19' ' ' CYS . 0.9 OUTLIER -97.09 47.52 1.04 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.968 -176.312 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -141.2 141.54 34.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.23 177.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.523 ' HA ' ' HG3' ' A' ' 8' ' ' ARG . 30.3 m -100.29 131.85 45.99 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.439 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.13 -68.63 0.87 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.13 0.49 . . . . 0.0 109.839 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -115.32 29.89 7.05 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 178.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.523 ' HG3' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -96.66 61.3 1.89 Allowed 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 -176.204 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -166.92 45.25 0.06 Allowed 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.34 -1.3 . . . . 0.0 109.323 171.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -163.86 -37.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.205 -175.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -77.63 -31.06 52.57 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.783 -176.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 115.41 162.02 13.32 Favored Glycine 0 N--CA 1.439 -1.131 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -170.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -59.25 114.37 2.6 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 117.145 0.472 . . . . 0.0 111.389 -175.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -77.88 85.86 4.12 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.734 174.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.407 HG23 ' H ' ' A' ' 15' ' ' VAL . 0.0 OUTLIER -71.73 -6.45 7.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 121.263 0.554 . . . . 0.0 109.627 179.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.13 -32.48 50.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.82 174.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.531 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -72.3 172.71 9.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.411 0.624 . . . . 0.0 112.094 -168.452 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.49 -51.28 5.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.307 -179.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.455 ' CB ' ' HA ' ' A' ' 3' ' ' GLU . 4.6 t -103.63 138.4 40.34 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 169.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.717 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.8 mm-40 -118.98 132.44 56.07 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.469 0.652 . . . . 0.0 112.652 -167.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.413 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER -138.59 119.49 14.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.625 169.235 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.439 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 5.9 t70 -156.64 -168.78 2.79 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 165.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.19 -29.31 70.68 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.736 0.779 . . . . 0.0 108.952 169.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.435 HD23 ' CD2' ' A' ' 27' ' ' TYR . 0.4 OUTLIER -89.07 14.66 10.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.667 -178.148 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.439 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -62.22 -37.99 87.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.623 0.249 . . . . 0.0 110.862 -178.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.85 -26.7 63.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.934 0.397 . . . . 0.0 111.011 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.435 ' CD2' HD23 ' A' ' 24' ' ' LEU . 58.5 t80 -67.42 -36.32 81.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.943 -178.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -100.72 -15.69 17.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.91 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 53.53 58.54 5.08 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.075 -178.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.7 m -148.77 48.42 1.01 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.472 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.717 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.63 138.08 34.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.908 0.385 . . . . 0.0 111.397 -176.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.13 162.23 28.69 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.837 177.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -27.22 68.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.257 0.551 . . . . 0.0 111.018 177.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.87 -10.29 59.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.37 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.451 ' CE2' ' HG3' ' A' ' 41' ' ' PRO . 31.7 t80 -67.33 -46.66 72.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.361 0.601 . . . . 0.0 110.048 -176.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.61 -29.35 62.32 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.64 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.87 -50.42 42.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.429 178.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.411 ' OE1' ' HA ' ' A' ' 38' ' ' GLU . 4.9 mm-40 -88.71 -43.26 11.43 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -173.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.0 t -84.33 -42.96 15.24 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.592 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.93 65.36 3.35 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.251 178.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.451 ' HG3' ' CE2' ' A' ' 35' ' ' TYR . 87.8 Cg_endo -77.82 -18.77 13.06 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.375 2.05 . . . . 0.0 111.017 175.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -135.03 110.61 9.17 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.047 -0.979 . . . . 0.0 109.601 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.2 t -85.93 149.24 4.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.55 176.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.05 130.73 45.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.475 178.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -81.34 162.05 23.58 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.693 0.282 . . . . 0.0 110.286 -178.054 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -136.06 145.97 17.94 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.415 -177.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.2 t70 . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.326 -0.845 . . . . 0.0 110.311 -178.383 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.455 ' O ' ' HB3' ' A' ' 2' ' ' GLN . 9.8 t70 . . . . . 0 N--CA 1.479 1.017 0 CA-C-O 120.803 0.335 . . . . 0.0 110.477 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.492 ' HG2' ' HG3' ' A' ' 3' ' ' GLU . 0.2 OUTLIER 170.74 -31.23 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.237 -0.892 . . . . 0.0 108.75 179.341 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.755 ' HA ' ' HB2' ' A' ' 19' ' ' CYS . 0.9 OUTLIER -100.07 41.53 1.16 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.065 -0.97 . . . . 0.0 108.697 173.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -128.99 123.12 31.6 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.62 -178.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -85.44 138.33 32.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.794 -176.65 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -125.9 -52.1 1.56 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 173.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -166.22 43.26 0.27 Allowed Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.662 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.424 ' HD2' ' SG ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -95.44 12.42 29.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.412 0.625 . . . . 0.0 109.99 177.925 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -79.89 -2.59 44.3 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.433 179.624 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.94 -1.78 18.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.346 -178.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -98.49 -8.78 26.07 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.719 0.295 . . . . 0.0 110.743 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.68 162.32 35.96 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.138 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.579 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 4.5 t80 -74.77 106.87 6.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.278 0.561 . . . . 0.0 110.438 177.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.479 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -99.85 102.27 13.64 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.099 174.523 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.576 HG13 ' HE1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -78.54 41.13 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.12 0.486 . . . . 0.0 110.758 -175.569 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -166.69 24.32 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.033 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.479 ' HG2' ' HB3' ' A' ' 14' ' ' ASN . 9.0 mmtm -89.3 -103.44 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.175 0.512 . . . . 0.0 110.228 176.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.432 ' HG3' ' C ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -150.48 -56.06 0.16 Allowed 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.161 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.755 ' HB2' ' HA ' ' A' ' 3' ' ' GLU . 1.8 t -124.84 147.76 48.58 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.465 171.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.637 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 2.7 mp0 -125.32 131.66 53.0 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.898 0.38 . . . . 0.0 111.679 -171.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.46 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 11.4 m -137.88 118.98 14.42 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 170.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -152.1 -170.62 3.69 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -69.05 -30.92 69.36 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 167.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mt -85.66 14.99 5.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.843 -178.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.578 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -63.55 -39.49 94.54 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 178.401 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.99 -28.52 62.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.833 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -65.49 -47.37 76.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.708 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -89.33 -11.97 41.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.008 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 53.81 43.78 30.49 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.175 0.512 . . . . 0.0 110.516 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 m -139.55 58.59 1.61 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.874 -176.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.637 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -110.48 156.0 21.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.329 177.096 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.6 m -72.48 156.2 39.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.491 177.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -22.34 66.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.988 -177.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.46 21.48 12.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.107 -177.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.483 ' O ' ' HB2' ' A' ' 39' ' ' CYS . 20.8 t80 -60.82 -50.96 71.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.119 0.485 . . . . 0.0 110.683 -177.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.471 ' O ' ' HE2' ' A' ' 40' ' ' LYS . 0.8 OUTLIER -72.98 -30.27 63.68 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.381 -177.383 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.72 -46.33 66.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.655 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 71.6 mm-40 -95.86 -39.99 9.54 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -173.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 96.0 m -82.43 -44.45 16.05 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.808 -178.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.471 ' HE2' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 59.32 78.0 0.36 Allowed Pre-proline 0 CA--C 1.531 0.221 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.147 179.851 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -63.31 -21.38 71.74 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.829 2.353 . . . . 0.0 112.589 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 56.53 48.38 16.8 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.09 177.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 p -99.51 123.69 52.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.262 0.553 . . . . 0.0 110.89 -178.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.43 -157.57 0.16 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.422 177.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -140.65 113.67 8.39 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 121.84 -0.538 . . . . 0.0 111.763 -178.387 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -92.41 104.65 3.2 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 110.934 -0.866 . . . . 0.0 110.934 172.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.1 t70 . . . . . 0 C--O 1.251 1.144 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.378 -177.682 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.714 0.292 . . . . 0.0 110.758 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.86 23.41 8.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.341 0.591 . . . . 0.0 110.053 179.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -96.54 2.95 52.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.978 -177.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.85 118.2 28.39 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.315 -179.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.559 ' H ' ' HB2' ' A' ' 34' ' ' ASP . 3.1 t -85.48 143.24 28.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.537 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.34 -89.83 0.51 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.851 0.358 . . . . 0.0 110.064 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.98 47.12 1.04 Allowed Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.711 -0.757 . . . . 0.0 111.646 178.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.468 ' HB2' ' NH1' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.27 8.23 36.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.112 0.482 . . . . 0.0 110.341 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.3 -15.04 48.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.35 0.595 . . . . 0.0 109.96 177.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.36 -10.12 59.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.177 -178.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -102.15 -5.89 23.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.546 178.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 79.15 -177.56 54.16 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.266 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -72.11 108.55 5.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.02 0.438 . . . . 0.0 110.798 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.42 ' C ' ' H ' ' A' ' 16' ' ' ASP . 2.0 t30 -99.14 105.57 17.66 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.583 172.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.405 HG23 ' H ' ' A' ' 15' ' ' VAL . 0.2 OUTLIER -78.8 41.28 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.667 0.746 . . . . 0.0 110.157 -179.127 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.42 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -128.35 -20.87 3.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.056 -0.974 . . . . 0.0 110.128 178.391 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 29.8 mmtm -91.31 -175.02 4.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.218 0.532 . . . . 0.0 111.495 -173.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.524 ' H ' ' HD2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -87.5 -69.52 0.68 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.248 -177.624 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.27 139.19 35.29 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 174.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.581 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -126.32 148.84 49.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.815 0.34 . . . . 0.0 110.886 -175.813 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 69.1 m -133.8 116.59 15.88 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 171.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.419 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 14.4 t70 -154.12 178.0 10.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.182 176.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.96 -27.21 64.55 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 168.753 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.404 ' N ' ' HG3' ' A' ' 23' ' ' GLU . 54.1 mt -82.46 14.7 2.88 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.406 178.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -58.63 -40.68 84.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.702 0.287 . . . . 0.0 110.743 -179.584 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -25.9 59.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.032 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -64.83 -49.4 70.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.584 -178.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -88.68 -15.92 33.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.844 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.69 48.85 5.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.308 -176.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 44.0 m -149.13 73.21 1.2 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.763 -178.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -114.42 149.01 36.86 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.021 177.004 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -75.63 152.76 37.57 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 175.934 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.85 -33.52 74.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -174.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.559 ' HB2' ' H ' ' A' ' 5' ' ' CYS . 0.8 OUTLIER -86.58 24.52 1.41 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.593 -176.568 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.482 ' O ' ' HB2' ' A' ' 39' ' ' CYS . 19.5 t80 -67.27 -50.72 59.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.231 0.539 . . . . 0.0 110.455 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.508 ' O ' ' HE3' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -73.65 -30.59 63.02 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.347 -175.783 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.69 -53.52 18.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.505 -178.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -90.76 -37.76 13.46 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -172.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 73.6 m -82.08 -55.93 4.26 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.179 -176.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.508 ' HE3' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 60.64 79.81 0.28 Allowed Pre-proline 0 N--CA 1.463 0.203 0 O-C-N 123.427 0.454 . . . . 0.0 110.904 179.609 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.425 ' HB2' HG23 ' A' ' 43' ' ' VAL . 40.7 Cg_endo -67.89 -5.38 14.37 Favored 'Trans proline' 0 CA--C 1.532 0.386 0 C-N-CA 123.119 2.546 . . . . 0.0 113.333 -176.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 59.59 32.17 21.41 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.008 0.433 . . . . 0.0 111.413 178.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.425 HG23 ' HB2' ' A' ' 41' ' ' PRO . 83.6 t -99.67 106.16 18.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.078 0.466 . . . . 0.0 110.307 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.01 -5.0 55.97 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.267 177.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.8 tpm_? 71.97 -59.32 0.56 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.3 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 97.72 29.6 7.66 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.804 -0.712 . . . . 0.0 111.424 -177.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.1 t70 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.62 -0.705 . . . . 0.0 110.225 -179.158 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 . . . . . 0 N--CA 1.482 1.152 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -151.46 53.06 0.84 Allowed 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 121.385 0.612 . . . . 0.0 111.065 -178.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -92.54 -4.57 53.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.503 0.668 . . . . 0.0 110.193 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.86 132.69 35.75 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.858 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.575 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 1.6 t -87.91 142.82 27.5 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.834 0.35 . . . . 0.0 110.742 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.44 ' HA ' ' HG3' ' A' ' 38' ' ' GLU . 14.4 mmtt -134.58 -79.42 0.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.722 175.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -132.82 59.85 0.68 Allowed Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.025 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.564 ' NH2' ' HB3' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -128.44 28.76 5.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.054 0.454 . . . . 0.0 110.218 178.413 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.1 OUTLIER -110.46 -11.51 14.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.283 177.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.32 -12.48 40.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.506 -177.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -96.91 -18.37 19.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.724 -177.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 118.94 -176.55 16.12 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.473 -177.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.676 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 9.4 t80 -81.73 108.34 15.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.881 0.372 . . . . 0.0 110.62 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -79.14 94.16 5.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.013 174.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.496 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -86.11 36.03 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-O 121.286 0.565 . . . . 0.0 110.519 -177.972 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -138.06 -13.23 1.42 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.823 -176.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.439 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 1.0 OUTLIER -92.84 -172.27 2.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.229 0.538 . . . . 0.0 111.963 -170.554 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.21 -17.3 46.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.258 -179.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.564 ' HB3' ' NH2' ' A' ' 8' ' ' ARG . 5.6 t -162.81 142.12 8.94 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.091 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.582 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -127.44 150.97 49.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.78 0.324 . . . . 0.0 111.311 -171.281 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.511 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 86.9 m -142.1 117.73 10.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.271 173.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.463 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 17.5 t70 -153.81 -177.77 6.61 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 171.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -68.61 -28.97 67.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 167.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mt -77.39 12.12 1.68 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.508 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.676 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -57.34 -42.57 82.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.074 179.51 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.44 -27.16 60.48 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.916 0.389 . . . . 0.0 111.084 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -67.41 -44.26 79.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.404 -178.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -90.72 -16.06 29.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.932 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 56.9 54.34 7.21 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.138 -174.102 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.2 m -154.34 76.64 1.04 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.156 -178.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.582 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -125.16 148.48 48.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.505 176.789 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.575 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 5.4 m -70.89 154.37 41.88 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.555 175.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.99 -28.74 69.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.617 -178.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.74 21.56 4.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.045 -178.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -65.36 -47.33 76.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.762 0.792 . . . . 0.0 109.285 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.446 ' O ' ' HE2' ' A' ' 40' ' ' LYS . 0.5 OUTLIER -74.06 -29.71 62.03 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.014 -179.755 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.71 -40.6 76.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.853 -177.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.44 ' HG3' ' HA ' ' A' ' 6' ' ' LYS . 64.8 mm-40 -98.38 -51.01 4.11 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -175.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 4.3 m -73.52 -34.68 65.38 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -177.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.446 ' HE2' ' O ' ' A' ' 36' ' ' THR . 0.2 OUTLIER 52.04 75.54 0.64 Allowed Pre-proline 0 N--CA 1.465 0.287 0 O-C-N 123.66 0.6 . . . . 0.0 112.232 173.892 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.508 ' O ' ' HB2' ' A' ' 42' ' ' GLN . 60.8 Cg_endo -79.17 38.39 0.72 Allowed 'Trans proline' 0 CA--C 1.529 0.264 0 C-N-CA 123.327 2.685 . . . . 0.0 111.748 176.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 20.1 mt-30 79.56 -44.06 0.3 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.099 0.96 . . . . 0.0 110.796 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.441 ' HB ' ' O ' ' A' ' 42' ' ' GLN . 82.0 t 77.65 121.42 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 O-C-N 124.189 0.931 . . . . 0.0 111.149 176.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.25 117.35 8.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.291 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -91.92 58.78 3.48 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.353 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -144.22 39.88 1.21 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.068 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.4 t70 . . . . . 0 C--O 1.252 1.211 0 CA-C-O 118.554 -0.736 . . . . 0.0 109.987 179.647 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 3.8 t0 . . . . . 0 N--CA 1.483 1.188 0 CA-C-O 121.144 0.497 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -103.97 90.69 3.68 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 176.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.578 ' HG3' ' HB2' ' A' ' 19' ' ' CYS . 0.4 OUTLIER -81.92 -179.4 7.38 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.904 179.394 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.7 m -120.78 140.18 52.06 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.78 -179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.636 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -78.55 127.64 32.43 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.094 178.539 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.453 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -98.71 -88.08 0.33 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.324 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.32 49.33 0.92 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 120.678 -0.772 . . . . 0.0 111.979 177.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.636 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 4.8 mmt85 -76.05 -6.83 52.9 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.826 0.346 . . . . 0.0 110.782 -175.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.413 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 23.7 m -79.53 -7.4 58.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.226 -176.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.54 -36.58 10.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.649 0.262 . . . . 0.0 111.062 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.39 -46.97 29.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.988 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 124.02 -178.69 16.37 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.013 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.665 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 4.0 t80 -79.53 108.5 13.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.879 0.371 . . . . 0.0 111.559 -178.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -94.44 105.09 17.05 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 168.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 t -64.41 -21.52 29.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.264 0.554 . . . . 0.0 109.916 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -94.54 41.04 1.09 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.074 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.472 ' HD2' ' HA ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -119.27 165.55 14.12 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 170.271 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.549 ' HG3' ' OE1' ' A' ' 3' ' ' GLU . 0.0 OUTLIER -87.64 -19.51 27.62 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.336 0.589 . . . . 0.0 110.143 -176.119 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.578 ' HB2' ' HG3' ' A' ' 3' ' ' GLU . 2.7 t -146.55 139.47 25.41 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 175.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.617 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -130.15 142.39 50.59 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -171.053 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.455 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 66.1 m -138.18 117.32 12.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.546 167.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.458 ' H ' ' HB3' ' A' ' 25' ' ' CYS . 35.7 t0 -154.9 179.97 8.61 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 175.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -15.53 63.42 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 166.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.8 mt -89.9 0.25 57.17 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.376 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.665 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -66.27 -25.58 66.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.735 0.303 . . . . 0.0 110.802 -176.337 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -39.82 62.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.896 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -63.35 -40.37 97.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.972 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -88.44 -15.44 35.44 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.321 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 54.64 45.28 27.15 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.53 -177.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.27 70.19 1.22 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.185 -178.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.617 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -109.61 148.61 31.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.118 176.154 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 21.1 m -65.29 157.77 28.16 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.931 0.396 . . . . 0.0 111.496 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.38 -26.18 63.6 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.277 0.56 . . . . 0.0 110.85 178.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.61 15.86 13.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.254 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.594 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 16.2 t80 -71.23 -39.46 71.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.699 -178.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -35.27 65.86 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.981 -179.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.07 -48.28 58.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.931 -178.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -90.81 -42.87 10.41 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -174.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.594 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 35.9 t -82.42 -51.94 7.36 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.379 -175.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.405 ' HE3' ' HB2' ' A' ' 40' ' ' LYS . 0.4 OUTLIER 57.72 75.56 0.54 Allowed Pre-proline 0 CA--C 1.531 0.242 0 O-C-N 123.607 0.567 . . . . 0.0 111.151 176.719 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -50.37 -49.44 16.48 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.089 2.526 . . . . 0.0 112.65 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 71.53 -12.01 0.67 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.288 0.635 . . . . 0.0 112.577 175.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -63.2 121.2 11.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.739 0.304 . . . . 0.0 110.519 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -119.52 138.89 52.88 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.403 178.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.3 ttm180 -150.05 113.51 4.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.795 0.331 . . . . 0.0 110.484 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -140.28 -116.44 1.32 Allowed Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.617 177.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.4 t70 . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.256 -0.878 . . . . 0.0 109.363 179.229 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.086 0 CA-C-O 120.925 0.393 . . . . 0.0 111.138 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.46 21.04 0.41 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.909 176.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.406 ' HG2' ' H ' ' A' ' 3' ' ' GLU . 1.3 pm0 -86.19 50.08 1.92 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.145 -177.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -136.93 152.01 49.7 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.884 176.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 2.6 t -80.33 138.18 36.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.801 0.334 . . . . 0.0 110.262 -178.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -134.28 -81.79 0.45 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.104 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -112.09 31.93 6.66 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 176.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.67 ' O ' ' HB2' ' A' ' 21' ' ' CYS . 2.9 mtt-85 -86.51 54.07 3.03 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 121.586 0.708 . . . . 0.0 109.87 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -150.64 18.64 0.81 Allowed 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 167.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.69 -36.65 0.21 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.924 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.525 ' HG2' ' HA ' ' A' ' 8' ' ' ARG . 17.2 pt-20 -68.6 -25.07 64.68 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.079 178.107 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 102.7 161.23 25.87 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.246 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.543 ' CE1' ' HG3' ' A' ' 20' ' ' GLN . 3.9 t80 -68.4 119.27 12.63 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.269 0.557 . . . . 0.0 110.607 178.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.548 ' HB3' ' HB2' ' A' ' 17' ' ' LYS . 4.2 t-20 -103.34 104.15 14.23 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.895 175.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -79.47 51.47 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 176.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -157.52 -41.99 0.07 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.671 -1.15 . . . . 0.0 109.475 -174.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.548 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -67.18 126.48 29.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.009 174.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.42 -59.26 1.63 Allowed 'General case' 0 N--CA 1.474 0.767 0 O-C-N 124.014 0.821 . . . . 0.0 113.172 -175.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -100.12 143.84 29.86 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 177.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.647 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.4 mm-40 -131.34 145.17 51.73 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.127 0.489 . . . . 0.0 112.108 -173.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.819 ' HB3' ' CD1' ' A' ' 35' ' ' TYR . 1.8 m -136.4 120.22 17.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.441 171.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.429 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 10.4 t70 -154.87 -171.49 3.85 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 172.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.04 -33.03 72.95 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 107.248 -1.389 . . . . 0.0 107.248 162.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.9 mp -77.85 14.39 1.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.557 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.429 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -65.59 -37.36 86.4 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 176.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -26.31 62.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.167 0.508 . . . . 0.0 110.582 176.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.403 ' HD2' ' CD2' ' A' ' 28' ' ' TYR . 91.7 t80 -66.34 -39.77 89.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.093 -178.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.403 ' CD2' ' HD2' ' A' ' 27' ' ' TYR . 43.6 m-85 -102.87 -8.68 20.54 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.657 0.265 . . . . 0.0 110.709 177.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 50.68 48.7 22.27 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.771 -177.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.6 m -140.22 54.34 1.63 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.51 -177.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.647 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.95 137.09 36.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.43 -178.316 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.23 151.77 43.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.943 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.9 -27.61 66.87 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -174.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.06 13.4 18.95 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.194 -176.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.819 ' CD1' ' HB3' ' A' ' 21' ' ' CYS . 3.3 t80 -63.86 -48.45 76.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.2 -178.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.07 -31.21 68.69 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.298 -177.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.58 -51.53 27.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.359 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -77.58 -49.52 14.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.983 -174.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 1.4 t -85.27 -54.49 4.57 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.85 -175.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 61.28 78.19 0.32 Allowed Pre-proline 0 C--O 1.233 0.225 0 O-C-N 123.49 0.494 . . . . 0.0 110.861 -177.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.24 -15.96 47.3 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.783 2.322 . . . . 0.0 112.313 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 72.5 142.42 0.06 Allowed 'General case' 0 C--O 1.233 0.195 0 O-C-N 124.01 0.819 . . . . 0.0 112.355 177.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -135.16 -172.22 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.008 176.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 m 60.07 63.45 1.43 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.415 0.626 . . . . 0.0 110.554 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.45 147.02 50.64 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.224 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 138.26 157.06 7.32 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.699 177.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.3 t70 . . . . . 0 C--O 1.246 0.905 0 CA-C-O 119.022 -0.513 . . . . 0.0 109.813 177.359 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 120.946 0.403 . . . . 0.0 110.48 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.564 ' O ' ' HB2' ' A' ' 3' ' ' GLU . 0.0 OUTLIER -82.84 163.08 21.41 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 178.568 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.564 ' HB2' ' O ' ' A' ' 2' ' ' GLN . 0.1 OUTLIER 80.42 129.67 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 O-C-N 124.27 0.981 . . . . 0.0 110.179 -176.004 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.68 171.37 14.45 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.059 -0.518 . . . . 0.0 109.632 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.557 ' HB2' ' HB2' ' A' ' 38' ' ' GLU . 87.0 m -65.74 153.45 41.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.432 0.634 . . . . 0.0 111.156 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.518 ' O ' ' HE3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -151.71 31.08 0.57 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.468 0.651 . . . . 0.0 109.397 175.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 80.58 33.4 31.14 Favored Glycine 0 N--CA 1.443 -0.84 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.806 -174.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -4.99 44.23 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.96 0.41 . . . . 0.0 110.288 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.598 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 35.3 m -68.7 1.74 3.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.162 177.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 p -86.26 -24.23 26.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.148 0.499 . . . . 0.0 110.319 176.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -98.76 -6.22 29.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.274 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.91 -166.76 34.13 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.316 -176.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.446 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 15.7 t80 -70.55 108.11 4.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.944 0.402 . . . . 0.0 110.822 178.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.439 HD21 ' HA ' ' A' ' 20' ' ' GLN . 0.5 OUTLIER -78.23 86.29 4.35 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.416 176.994 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.8 56.54 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.811 0.815 . . . . 0.0 109.571 177.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -155.01 -41.35 0.09 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.761 -1.109 . . . . 0.0 109.242 -176.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.549 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -76.17 173.02 11.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.846 -179.392 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.43 ' HB2' ' HE3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -85.59 -36.78 20.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.661 -174.718 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -111.5 138.73 47.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.688 174.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.536 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 18.9 mp0 -123.83 138.17 54.54 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.919 0.39 . . . . 0.0 111.195 -175.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.598 ' HB2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -139.7 117.35 11.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.138 0.494 . . . . 0.0 109.751 167.822 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.411 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 25.6 t0 -154.23 -176.57 5.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.086 -0.961 . . . . 0.0 108.691 175.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.52 -33.22 73.74 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 166.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.0 mt -75.51 14.43 0.61 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.799 178.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.436 ' HB2' ' HB3' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -61.57 -38.13 86.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.785 0.326 . . . . 0.0 110.194 -179.539 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.77 -26.52 59.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.113 178.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -64.94 -40.83 95.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.726 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -98.32 -13.35 20.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.651 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 55.56 48.88 17.76 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.477 0.656 . . . . 0.0 110.076 -174.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.427 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 27.3 m -149.3 76.85 1.34 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.945 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.536 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -120.74 150.96 40.16 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.931 176.617 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 3.5 m -70.81 144.25 50.87 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -29.55 69.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.895 0.378 . . . . 0.0 111.296 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -91.0 31.29 1.1 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.194 0.521 . . . . 0.0 110.957 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.4 ' HD1' ' HB3' ' A' ' 21' ' ' CYS . 17.8 t80 -65.52 -40.58 93.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.647 0.737 . . . . 0.0 109.652 179.204 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.446 ' HA ' ' HD2' ' A' ' 41' ' ' PRO . 0.1 OUTLIER -72.05 -34.08 68.49 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.726 179.73 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -71.12 -55.06 8.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.198 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.557 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 32.7 mt-10 -97.51 0.43 47.51 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -169.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -126.6 -36.74 2.22 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.444 173.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.24 74.87 0.51 Allowed Pre-proline 0 N--CA 1.465 0.29 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 171.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.446 ' HD2' ' HA ' ' A' ' 36' ' ' THR . 17.8 Cg_endo -61.06 -62.88 0.12 Allowed 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.275 1.984 . . . . 0.0 111.831 177.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -172.73 139.84 0.94 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.939 177.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.5 t -127.62 120.38 54.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 174.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -119.52 -161.32 0.85 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.296 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.94 -39.73 10.05 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 178.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 133.81 85.42 0.25 Allowed Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.079 178.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.1 t0 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.925 -0.559 . . . . 0.0 109.535 179.668 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 5.2 t0 . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -97.13 100.44 11.92 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.514 ' H ' ' HB3' ' A' ' 19' ' ' CYS . 0.6 OUTLIER -82.72 -172.52 4.13 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.77 -178.931 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -97.09 136.91 36.96 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.927 179.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.517 ' H ' ' HB2' ' A' ' 34' ' ' ASP . 0.9 OUTLIER -84.39 154.13 23.02 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.629 -178.315 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.528 ' HG3' ' N ' ' A' ' 7' ' ' GLY . 0.0 OUTLIER -164.01 -33.77 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.91 177.388 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.528 ' N ' ' HG3' ' A' ' 6' ' ' LYS . . . -154.47 63.35 0.35 Allowed Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.211 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.403 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -129.41 -37.34 1.63 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 175.623 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.4 -21.2 65.6 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.748 -178.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -85.69 -13.03 49.74 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.355 -176.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -111.16 -54.7 2.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.657 -177.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.99 -171.14 26.25 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.695 -0.765 . . . . 0.0 111.853 -179.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.705 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 3.2 t80 -83.61 112.48 20.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.921 0.391 . . . . 0.0 111.137 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.415 ' C ' ' H ' ' A' ' 16' ' ' ASP . 1.5 t30 -99.57 103.0 14.68 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 171.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.401 ' H ' HG23 ' A' ' 15' ' ' VAL . 0.2 OUTLIER -78.53 42.67 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.512 0.673 . . . . 0.0 109.962 -177.812 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -128.8 -27.66 2.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.405 -178.555 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.513 ' HB2' ' OE1' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -87.15 -165.58 1.34 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.786 -177.37 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.46 -61.88 1.47 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.186 -178.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.514 ' HB3' ' H ' ' A' ' 3' ' ' GLU . 1.0 OUTLIER -110.22 138.88 46.0 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.273 0.558 . . . . 0.0 109.86 176.821 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.643 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 4.2 mp0 -120.32 152.42 37.85 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.622 -177.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.471 ' HB3' ' CD2' ' A' ' 35' ' ' TYR . 86.2 m -123.12 113.44 18.98 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 168.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.497 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 13.1 t70 -156.66 179.04 9.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.995 178.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.46 -35.53 75.72 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 165.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.1 mt -77.11 9.38 3.07 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.654 -179.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.705 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -60.86 -41.74 96.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.169 -175.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.66 -29.89 63.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.247 -177.003 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -62.85 -48.92 76.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.782 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -84.0 -15.16 48.69 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.226 177.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.82 45.35 15.57 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.611 -178.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -138.17 63.03 1.55 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.465 -178.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.643 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -102.77 153.28 20.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.875 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.46 ' HB3' ' O ' ' A' ' 3' ' ' GLU . 1.9 m -82.16 139.08 34.54 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 171.5 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -21.91 65.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.278 0.561 . . . . 0.0 111.474 -177.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.517 ' HB2' ' H ' ' A' ' 5' ' ' CYS . 0.7 OUTLIER -86.04 17.85 3.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.237 -175.345 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.471 ' CD2' ' HB3' ' A' ' 21' ' ' CYS . 15.0 t80 -64.53 -55.57 19.7 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.369 0.605 . . . . 0.0 110.409 -178.309 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.2 p -70.62 -29.03 65.3 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.254 -175.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -68.47 -55.08 13.01 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.892 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -91.36 -50.98 5.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.3 m -71.53 -47.27 56.27 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 121.225 -0.19 . . . . 0.0 111.055 -173.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 mtpp 59.36 77.5 0.39 Allowed Pre-proline 0 N--CA 1.464 0.231 0 O-C-N 123.409 0.443 . . . . 0.0 110.569 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -56.66 -64.05 0.15 Allowed 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 123.313 2.675 . . . . 0.0 112.573 -175.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -155.91 121.36 4.87 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.633 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.1 t -95.1 85.08 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 174.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -64.63 105.58 1.0 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.521 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -79.65 104.79 10.48 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 176.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.49 46.83 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 -177.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.482 -0.77 . . . . 0.0 110.48 -177.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.281 0 CA-C-O 120.487 0.184 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -153.88 161.03 42.35 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 177.106 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.61 34.39 23.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.572 0.701 . . . . 0.0 110.27 -175.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.552 ' HA ' ' HB2' ' A' ' 34' ' ' ASP . 0.8 OUTLIER -64.55 133.83 53.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.857 -178.574 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.473 ' HB3' ' HG3' ' A' ' 8' ' ' ARG . 2.8 m -77.97 119.7 21.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.904 177.356 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 mtmt -119.76 -54.77 2.13 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 176.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.88 -17.85 42.62 Favored Glycine 0 N--CA 1.44 -1.079 0 CA-C-N 115.276 -0.875 . . . . 0.0 112.349 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.473 ' HG3' ' HB3' ' A' ' 5' ' ' CYS . 0.1 OUTLIER -98.62 40.85 1.17 Allowed 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 122.025 -0.691 . . . . 0.0 110.501 -173.456 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.636 ' HA ' ' O ' ' A' ' 21' ' ' CYS . 0.8 OUTLIER -131.44 -7.29 3.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.455 177.007 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.39 2.47 8.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.72 -174.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -104.68 12.21 33.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.225 0.536 . . . . 0.0 110.389 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 86.75 -173.29 45.2 Favored Glycine 0 N--CA 1.442 -0.953 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.601 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 7.9 t80 -93.73 107.13 19.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.691 0.282 . . . . 0.0 110.439 -178.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.36 95.25 8.68 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.851 173.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.452 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -80.78 41.32 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.522 0.677 . . . . 0.0 110.115 -178.314 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -134.31 -13.26 2.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.051 -178.335 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 13.9 mmtm -91.85 179.3 5.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.143 0.497 . . . . 0.0 111.904 -170.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.92 -29.88 28.86 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.622 -178.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -140.01 149.45 43.23 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.601 ' HG2' ' CE1' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -130.73 146.09 52.11 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.999 -174.265 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.636 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 4.1 m -143.88 117.79 9.38 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 169.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.591 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 17.6 t70 -154.64 -179.35 7.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -69.12 -29.48 67.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 166.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 50.5 mt -79.56 14.42 1.65 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.167 176.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.591 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -63.28 -39.32 94.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.706 -0.225 . . . . 0.0 110.548 -179.867 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.95 -28.27 61.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.131 -179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -64.15 -52.32 59.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.664 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -85.18 -16.17 41.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.927 -179.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.0 44.64 22.52 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.98 -179.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.6 m -141.77 56.74 1.5 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.192 -177.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.549 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.1 OUTLIER -108.76 146.03 34.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.663 179.131 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 m -69.55 156.88 38.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.891 179.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -28.57 69.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.968 0.413 . . . . 0.0 111.989 -177.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.552 ' HB2' ' HA ' ' A' ' 4' ' ' SER . 2.5 m-20 -85.25 13.97 5.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.293 -175.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.46 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 46.3 t80 -66.72 -50.5 62.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.094 0.473 . . . . 0.0 110.637 -177.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.477 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -70.63 -28.61 64.95 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.104 -178.224 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.52 -52.75 50.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.969 178.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -89.63 -53.74 4.39 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -71.01 -44.37 66.01 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.696 -172.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' A' ' 36' ' ' THR . 0.2 OUTLIER 58.07 85.1 0.19 Allowed Pre-proline 0 N--CA 1.465 0.323 0 O-C-N 123.712 0.632 . . . . 0.0 112.088 176.861 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -75.98 -16.79 17.91 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.474 2.116 . . . . 0.0 111.501 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 61.81 86.69 0.11 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 115.234 -0.894 . . . . 0.0 111.153 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -86.76 153.05 3.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.001 -178.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.6 m -121.97 -6.54 8.98 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.91 -177.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 68.12 11.73 8.48 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.335 178.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.35 -125.45 7.15 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.141 -178.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.6 t70 . . . . . 0 C--O 1.244 0.802 0 CA-C-O 118.463 -0.78 . . . . 0.0 109.952 -179.33 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.58 132.53 42.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.853 0.359 . . . . 0.0 110.474 177.734 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.16 87.87 4.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.893 -177.376 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 74.0 m -77.98 146.7 35.28 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.258 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.635 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 44.4 t -83.05 149.87 26.67 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.358 -178.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -162.48 -64.26 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 123.555 0.535 . . . . 0.0 110.179 173.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.81 34.16 4.8 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.422 -173.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.477 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 2.2 mmp_? -98.97 -32.95 11.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.419 0.61 . . . . 0.0 110.149 175.032 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.465 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 1.0 OUTLIER -68.55 -21.69 64.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.416 -175.021 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.58 -27.52 45.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.265 -177.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.95 -50.31 4.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.891 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 135.77 -156.97 23.09 Favored Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 111.296 -0.722 . . . . 0.0 111.296 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.57 ' CE1' ' HG2' ' A' ' 20' ' ' GLN . 3.9 t80 -84.29 107.83 16.8 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.132 0.491 . . . . 0.0 110.915 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.415 ' C ' ' H ' ' A' ' 16' ' ' ASP . 0.2 OUTLIER -89.63 93.04 9.32 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.589 173.507 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.419 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -78.47 35.97 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.131 0.491 . . . . 0.0 110.885 -176.634 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 14' ' ' ASN . 0.2 OUTLIER -133.37 2.3 3.53 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.114 177.569 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.5 mmpp? -109.08 -169.52 1.5 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.311 -178.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.17 -63.79 1.11 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.452 -178.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.08 138.57 35.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.941 177.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.57 ' HG2' ' CE1' ' A' ' 13' ' ' PHE . 2.3 mp0 -129.08 145.61 51.23 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.271 -174.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.2 m -135.57 116.36 14.03 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 168.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -155.04 179.16 9.41 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.449 -0.796 . . . . 0.0 108.994 174.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.58 -22.07 63.56 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 167.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.6 mt -81.24 10.9 4.78 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.367 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -38.13 86.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.739 0.305 . . . . 0.0 110.567 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -26.8 65.65 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.403 179.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -77.81 -52.37 9.0 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.377 -176.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.405 ' HB2' ' CZ ' ' A' ' 13' ' ' PHE . 50.5 m-85 -88.25 -16.69 32.52 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.347 -177.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 72.8 mm-40 53.89 54.45 9.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.308 0.575 . . . . 0.0 111.028 -177.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.34 39.51 3.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.766 -178.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -98.53 147.58 24.62 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.226 -177.25 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.635 ' SG ' ' HB2' ' A' ' 5' ' ' CYS . 1.9 m -77.98 164.13 25.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.164 178.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.62 -38.11 86.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.931 -177.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.43 32.88 1.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.21 0.529 . . . . 0.0 110.929 -178.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.465 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 16.8 t80 -72.17 -41.75 66.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.5 0.667 . . . . 0.0 109.676 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -30.09 70.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.236 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.21 -54.63 11.99 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.258 177.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.618 ' HG3' ' O ' ' A' ' 5' ' ' CYS . 46.3 mm-40 -68.73 -53.13 23.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.829 -175.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.519 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 0.5 OUTLIER -73.15 -48.79 32.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.524 -177.805 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.68 61.33 12.6 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.935 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.519 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 64.8 Cg_endo -81.14 -42.48 0.12 Allowed 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 121.902 1.735 . . . . 0.0 111.526 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -164.13 138.18 5.53 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.335 -0.848 . . . . 0.0 108.713 -178.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 61.7 t -80.69 113.61 20.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.593 ' O ' ' HD3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -75.9 38.98 0.17 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.145 -0.48 . . . . 0.0 112.264 -176.446 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.593 ' HD3' ' O ' ' A' ' 44' ' ' THR . 0.0 OUTLIER -158.79 155.53 28.09 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -178.435 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -130.63 -152.3 7.35 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.086 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.0 t70 . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.349 -0.834 . . . . 0.0 109.804 -179.972 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.1 t0 . . . . . 0 N--CA 1.48 1.039 0 CA-C-O 121.287 0.565 . . . . 0.0 110.578 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.76 151.4 49.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.963 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -78.77 71.08 5.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.381 0.61 . . . . 0.0 110.128 178.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -150.62 161.54 42.39 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.018 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.494 ' HB3' ' HG2' ' A' ' 38' ' ' GLU . 30.0 m -112.13 122.07 46.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 176.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.454 ' HE2' ' O ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -146.58 28.91 1.05 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.063 0.459 . . . . 0.0 110.567 -178.501 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 141.97 26.28 0.18 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.799 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.43 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.2 OUTLIER -82.37 -27.38 32.15 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.494 ' HB2' ' OE1' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -70.1 -18.49 63.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.27 0.557 . . . . 0.0 110.208 -179.921 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -107.48 -11.38 15.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.355 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.92 -16.94 14.71 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.067 0.461 . . . . 0.0 110.683 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 112.67 146.05 9.75 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.812 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.561 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 10.0 t80 -56.22 107.36 0.36 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.454 0.645 . . . . 0.0 110.655 178.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.534 HD21 ' HA ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -83.66 81.92 8.54 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.45 179.307 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.415 HG23 ' H ' ' A' ' 15' ' ' VAL . 0.0 OUTLIER -69.97 -1.18 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.053 0.454 . . . . 0.0 110.412 -178.672 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.56 -9.28 25.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.193 179.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.409 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -96.63 -176.63 3.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.795 0.331 . . . . 0.0 111.344 -176.084 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -82.03 -56.09 4.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.649 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.43 138.23 48.19 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.616 -0.512 . . . . 0.0 109.616 176.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.652 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -127.82 149.63 50.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.278 -171.942 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 53.8 m -144.92 119.37 9.65 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.343 174.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.491 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 6.8 t0 -153.1 -174.8 5.07 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 169.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -68.29 -21.89 64.76 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 170.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -86.41 14.47 6.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.99 177.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.561 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -59.41 -40.96 88.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.611 178.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -26.03 60.64 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.004 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -66.21 -45.64 80.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.63 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -90.91 -17.0 27.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.769 0.319 . . . . 0.0 110.745 178.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 52.81 50.36 18.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.573 -174.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -142.04 48.24 1.6 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.079 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.652 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -96.64 146.77 24.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.799 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.23 160.77 27.74 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.397 177.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -29.5 70.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.938 -178.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -85.82 28.25 0.8 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.749 0.309 . . . . 0.0 111.234 -179.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -70.51 -47.58 59.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.459 0.647 . . . . 0.0 110.082 -178.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -28.88 66.42 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.997 -178.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.98 -48.96 74.35 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.747 178.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.494 ' HG2' ' HB3' ' A' ' 5' ' ' CYS . 0.3 OUTLIER -87.58 -40.39 14.27 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.484 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.43 ' N ' ' HG3' ' A' ' 38' ' ' GLU . 49.1 t -91.81 -55.57 3.42 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.333 -175.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 tttt 47.85 67.41 4.51 Favored Pre-proline 0 N--CA 1.465 0.299 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.119 -173.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.97 -47.45 17.93 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.579 2.186 . . . . 0.0 111.515 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.4 -69.6 0.07 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.182 176.177 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.55 HG13 ' HB2' ' A' ' 45' ' ' ARG . 14.2 p -162.5 151.72 3.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.559 178.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.68 52.1 0.8 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.076 0.465 . . . . 0.0 111.708 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.55 ' HB2' HG13 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -101.36 48.05 0.9 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.067 0.461 . . . . 0.0 111.05 -177.504 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -112.45 -7.93 21.88 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.762 -0.732 . . . . 0.0 111.799 178.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.7 t70 . . . . . 0 C--O 1.245 0.816 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -178.323 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 38.8 t0 . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.76 37.0 22.27 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.39 0.614 . . . . 0.0 110.323 -175.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.438 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -94.56 7.52 45.37 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.745 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.31 147.68 7.58 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.836 178.052 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 3.5 t -82.93 118.6 23.58 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.418 -176.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.438 ' HE2' ' O ' ' A' ' 5' ' ' CYS . 13.5 mmtt -141.63 -60.98 0.47 Allowed 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 175.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -128.32 51.68 0.85 Allowed Glycine 0 N--CA 1.444 -0.794 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.851 176.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.53 ' HB2' ' HB2' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -91.71 -21.1 20.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.113 0.482 . . . . 0.0 109.761 177.004 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -76.54 -18.12 58.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.76 -176.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.76 -21.16 41.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.765 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.6 -42.22 6.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.18 -179.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 122.1 179.54 15.97 Favored Glycine 0 N--CA 1.444 -0.768 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 -177.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.713 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 6.6 t80 -62.36 107.11 0.85 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.185 0.517 . . . . 0.0 110.635 177.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.426 ' ND2' ' HB2' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -89.3 84.59 6.48 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.852 176.161 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.462 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -68.45 -14.48 18.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.2 0.524 . . . . 0.0 109.902 -177.955 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -21.44 54.81 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.224 177.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.426 ' HB2' ' ND2' ' A' ' 14' ' ' ASN . 1.7 mmpp? -84.02 171.2 13.16 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.14 -9.87 37.9 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.117 0.484 . . . . 0.0 110.36 -179.011 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.438 ' HB2' ' HB2' ' A' ' 3' ' ' GLU . 1.8 t -137.2 138.2 39.93 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 172.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.576 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 26.7 mp0 -131.8 148.03 52.53 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.844 0.354 . . . . 0.0 111.86 -169.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.53 ' HB2' ' HB2' ' A' ' 8' ' ' ARG . 64.8 m -142.34 118.26 10.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.725 170.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -153.3 -173.7 4.67 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 167.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -19.46 63.74 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 169.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 mt -88.44 14.62 9.3 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.252 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.713 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -60.73 -37.38 81.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.68 0.276 . . . . 0.0 110.776 -178.578 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -26.7 60.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.245 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -68.46 -44.07 75.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.582 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -88.43 -15.75 34.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.406 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 56.8 49.5 14.14 Favored 'General case' 0 CA--C 1.522 -0.1 0 O-C-N 123.713 0.633 . . . . 0.0 110.152 -176.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.2 m -151.39 76.47 1.22 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.224 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -118.67 151.5 37.84 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.994 176.179 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 5' ' ' CYS . 3.3 m -80.11 160.12 25.85 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.91 0.386 . . . . 0.0 110.967 177.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -26.92 68.89 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.142 0.496 . . . . 0.0 111.317 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.61 7.34 36.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.486 -177.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.468 ' CD1' ' HB3' ' A' ' 21' ' ' CYS . 13.5 t80 -62.59 -47.18 84.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.323 0.582 . . . . 0.0 110.123 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -32.97 63.94 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.057 -178.316 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.89 -50.45 34.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.036 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -93.1 -35.63 13.1 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -172.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 35' ' ' TYR . 69.6 m -97.03 -55.17 2.95 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.428 -177.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 64.95 102.85 0.03 OUTLIER Pre-proline 0 C--O 1.232 0.153 0 O-C-N 123.612 0.57 . . . . 0.0 110.868 179.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -51.99 -46.69 30.77 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 123.071 2.514 . . . . 0.0 111.998 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 60.23 28.67 18.28 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.358 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 p -116.12 128.0 73.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 177.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.51 120.05 27.43 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.897 0.38 . . . . 0.0 111.312 -176.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -82.86 97.75 8.81 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -81.02 47.43 3.56 Favored Glycine 0 N--CA 1.454 -0.134 0 C-N-CA 121.179 -0.534 . . . . 0.0 113.169 -174.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.294 -0.86 . . . . 0.0 109.547 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.49 ' HB2' ' H ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 110.458 -0.201 . . . . 0.0 110.458 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.49 ' H ' ' HB2' ' A' ' 1' ' ' ASP . 0.8 OUTLIER -86.42 136.25 33.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.089 0.471 . . . . 0.0 111.246 -174.582 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.4 2.0 10.74 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.291 175.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -98.48 141.81 30.88 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.944 -170.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.406 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 6.1 t -92.49 142.55 27.29 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.687 175.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.423 ' HB2' ' HE2' ' A' ' 6' ' ' LYS . 12.6 mtmm -118.82 -78.02 0.58 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.901 0.382 . . . . 0.0 110.328 178.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -143.19 31.63 1.94 Allowed Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.512 -0.851 . . . . 0.0 111.884 -176.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -82.33 8.95 9.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.867 0.365 . . . . 0.0 111.188 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.478 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 25.9 m -74.66 -16.69 60.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.44 0.638 . . . . 0.0 109.563 176.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -110.1 10.8 23.96 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.286 -177.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -110.45 11.92 23.07 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.697 0.761 . . . . 0.0 109.439 175.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.93 161.4 32.22 Favored Glycine 0 N--CA 1.445 -0.764 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.2 -177.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -73.56 107.2 5.69 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.287 175.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.478 HD21 ' HA ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -83.81 112.18 19.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.023 178.363 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -90.57 3.51 6.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.023 0.44 . . . . 0.0 110.555 -177.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -138.73 53.45 1.77 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.233 0.54 . . . . 0.0 110.88 177.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.445 ' CG ' ' HB2' ' A' ' 14' ' ' ASN . 6.8 mmmm -129.51 -171.3 2.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.8 172.4 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.2 -58.42 4.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.27 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -132.05 153.41 50.45 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.515 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.523 ' HG2' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -126.7 141.7 51.76 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -171.899 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.478 ' HB3' ' SG ' ' A' ' 9' ' ' CYS . 92.7 m -139.15 119.3 13.56 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.875 0.369 . . . . 0.0 110.986 174.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 19.2 t70 -153.93 -172.96 4.39 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 168.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.37 -23.8 63.79 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 167.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.1 mt -80.5 8.92 6.72 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.346 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.442 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -61.13 -39.1 88.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.879 0.371 . . . . 0.0 110.066 179.367 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.85 -26.66 62.45 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.104 178.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -66.85 -42.09 86.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.68 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -96.1 -17.5 20.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.03 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 55.47 47.06 21.87 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.101 0.477 . . . . 0.0 110.941 -175.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.523 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 0.3 OUTLIER -141.94 46.73 1.65 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.183 -178.197 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -95.29 153.71 17.54 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.593 179.815 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.42 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -66.62 156.41 35.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.582 179.08 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -37.71 75.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -172.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.425 ' HB2' ' HB3' ' A' ' 37' ' ' ALA . 9.8 p30 -103.39 31.74 4.18 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.982 0.42 . . . . 0.0 110.979 -175.358 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.603 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 7.9 t80 -62.59 -42.88 99.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.492 0.663 . . . . 0.0 109.265 178.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.541 ' O ' ' HD3' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -73.35 -32.4 64.51 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.85 179.724 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.425 ' HB3' ' HB2' ' A' ' 34' ' ' ASP . . . -66.61 -57.62 6.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.527 -178.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -87.17 -41.9 13.4 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.603 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 52.0 t -78.94 -46.8 17.61 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.401 -175.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.541 ' HD3' ' O ' ' A' ' 36' ' ' THR . 0.3 OUTLIER 55.3 75.4 0.6 Allowed Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.891 177.206 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo -48.01 -49.74 13.29 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.451 2.767 . . . . 0.0 112.545 -178.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.503 ' HA ' ' OE1' ' A' ' 42' ' ' GLN . 1.9 tp-100 49.32 51.68 15.86 Favored 'General case' 0 N--CA 1.462 0.145 0 O-C-N 123.598 0.561 . . . . 0.0 111.783 178.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.512 HG12 ' HB2' ' A' ' 45' ' ' ARG . 19.1 t -95.19 112.81 28.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.033 178.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -77.68 60.23 2.15 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.057 0.456 . . . . 0.0 111.043 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.512 ' HB2' HG12 ' A' ' 43' ' ' VAL . 0.1 OUTLIER -123.58 -98.92 0.42 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.631 -178.213 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.443 ' H ' ' HB3' ' A' ' 45' ' ' ARG . . . 67.12 -139.3 35.82 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.979 -178.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.3 t70 . . . . . 0 C--O 1.249 1.059 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.136 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.481 ' OD2' ' HB2' ' A' ' 18' ' ' LYS . 1.7 t70 . . . . . 0 N--CA 1.48 1.046 0 CA-C-O 120.551 0.215 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -76.67 -3.98 40.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.928 0.395 . . . . 0.0 111.789 -175.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -94.42 -158.54 0.64 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.97 0.414 . . . . 0.0 110.51 179.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.02 170.3 13.12 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.723 0.773 . . . . 0.0 112.268 -177.543 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 38.5 t -91.28 125.17 35.96 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.189 177.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.78 4.98 43.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.266 0.555 . . . . 0.0 110.021 177.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.601 ' HA2' ' SG ' ' A' ' 39' ' ' CYS . . . 114.71 55.84 0.38 Allowed Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.561 -174.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.666 ' HG3' ' SG ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -84.08 7.14 19.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.469 0.652 . . . . 0.0 109.953 -178.908 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.477 ' SG ' ' HE1' ' A' ' 35' ' ' TYR . 16.4 m -72.34 -3.79 25.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.348 176.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 15.7 p -79.77 -24.61 41.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.474 0.654 . . . . 0.0 109.715 172.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -95.57 -22.8 17.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.493 -177.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.72 177.0 45.46 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 -176.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.696 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 4.0 t80 -72.87 108.39 5.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.145 0.497 . . . . 0.0 110.741 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.538 ' HB3' ' HB2' ' A' ' 17' ' ' LYS . 7.6 t-20 -96.74 106.97 19.35 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 172.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -75.49 -3.77 5.26 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -94.11 -6.86 44.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.752 176.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.538 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -94.69 159.95 14.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.843 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.585 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -84.53 -34.24 23.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.774 0.321 . . . . 0.0 110.567 -174.85 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -120.0 138.44 53.49 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 171.218 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.584 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 22.1 mp0 -127.01 140.89 51.97 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.735 -173.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.666 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -135.1 115.59 13.61 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.171 167.429 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.602 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 24.8 t70 -155.78 179.35 9.28 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.031 173.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -68.63 -26.76 65.51 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 168.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mt -76.95 5.89 7.18 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.466 177.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.696 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -61.34 -38.44 86.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.828 0.346 . . . . 0.0 110.547 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.99 -27.51 64.76 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.914 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -70.7 -46.87 62.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.903 -178.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -88.21 -12.79 42.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.658 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 55.17 47.67 21.21 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 121.639 0.733 . . . . 0.0 109.643 -174.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 16.5 m -145.12 77.76 1.53 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.189 -177.192 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.584 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -126.8 151.18 48.63 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.333 175.378 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.6 m -73.85 141.43 46.13 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 172.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -31.59 64.08 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -174.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.42 21.93 1.36 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.444 -177.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.477 ' HE1' ' SG ' ' A' ' 9' ' ' CYS . 19.2 t80 -67.99 -49.37 62.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.301 0.572 . . . . 0.0 110.324 -177.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.433 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 0.3 OUTLIER -73.6 -29.98 62.72 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.648 -176.427 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.87 -45.79 66.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.517 177.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -89.02 -53.91 4.37 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -174.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.601 ' SG ' ' HA2' ' A' ' 7' ' ' GLY . 1.4 m -76.2 -40.21 52.84 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.365 -175.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.76 92.05 0.07 OUTLIER Pre-proline 0 N--CA 1.464 0.237 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.386 175.258 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 36' ' ' THR . 2.4 Cg_endo -81.1 -149.05 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.028 2.486 . . . . 0.0 111.365 175.179 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -132.25 15.58 4.59 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.106 -179.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 67.8 t 66.93 101.39 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 CA-C-N 116.114 -0.493 . . . . 0.0 109.819 -173.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.76 83.77 0.3 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.471 -175.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -119.78 116.56 26.16 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 173.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -76.64 -25.94 64.1 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.479 -179.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.079 0 CA-C-O 117.852 -1.07 . . . . 0.0 109.435 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.481 1.102 0 CA-C-O 119.909 -0.091 . . . . 0.0 110.831 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.37 83.07 0.14 Allowed 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.262 0.554 . . . . 0.0 110.04 -175.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.455 ' HA ' ' SG ' ' A' ' 32' ' ' CYS . 12.2 tp10 -69.71 97.23 1.04 Allowed 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.707 -172.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -168.38 107.38 0.5 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.649 175.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.792 ' SG ' ' HB2' ' A' ' 32' ' ' CYS . 84.0 m -97.55 162.83 13.11 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 168.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.48 -101.3 0.09 Allowed 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.851 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -96.13 4.79 65.33 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.217 -0.753 . . . . 0.0 111.217 -177.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.489 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 5.5 ptt-85 -79.61 66.77 5.18 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 122.063 0.935 . . . . 0.0 108.988 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.465 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -148.11 10.87 0.91 Allowed 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.744 166.685 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -145.9 9.93 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.59 177.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.424 ' HG3' ' HA ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -104.87 -27.49 11.69 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.75 -175.838 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 119.2 145.49 7.65 Favored Glycine 0 N--CA 1.444 -0.832 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 -173.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.67 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 12.9 t80 -69.91 107.37 3.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 121.312 0.577 . . . . 0.0 110.716 -174.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -84.55 97.62 9.68 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.421 174.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.654 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -87.32 28.83 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.216 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -135.87 19.58 3.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.515 -175.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.89 -176.1 2.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.605 179.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.93 -60.39 2.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.4 t -100.26 138.88 36.73 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 172.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.575 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.1 mp0 -108.6 135.35 50.0 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.923 0.392 . . . . 0.0 110.279 -175.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.516 ' SG ' ' HD1' ' A' ' 35' ' ' TYR . 0.8 OUTLIER -156.3 122.23 4.94 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.946 175.127 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.465 ' HA ' ' HA ' ' A' ' 9' ' ' CYS . 3.4 t70 -155.83 -169.03 2.96 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 160.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -14.53 62.96 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.181 0.515 . . . . 0.0 110.154 174.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.78 12.38 30.22 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.227 179.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.67 ' HA ' ' HE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -54.57 -40.45 68.79 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.634 0.254 . . . . 0.0 111.309 178.861 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -37.38 78.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.917 0.389 . . . . 0.0 111.028 -179.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -62.54 -48.31 80.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.679 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -81.83 -15.7 53.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.108 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 56.09 47.65 19.21 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.506 0.669 . . . . 0.0 110.334 -176.609 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.0 m -150.68 77.21 1.28 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.971 -177.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.575 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -125.9 157.26 38.15 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.27 174.994 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.792 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 2.6 m -71.02 158.84 35.81 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 174.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.12 -29.69 69.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.965 -173.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -94.38 32.97 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.483 0.658 . . . . 0.0 111.047 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.516 ' HD1' ' SG ' ' A' ' 21' ' ' CYS . 45.6 t80 -62.18 -38.72 90.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.583 179.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.535 ' O ' ' HA ' ' A' ' 40' ' ' LYS . 0.6 OUTLIER -69.96 -29.01 66.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.986 -179.814 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.72 -45.73 67.54 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.143 0.497 . . . . 0.0 111.006 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -82.11 -51.33 8.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.084 -175.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.6 t -75.65 -41.35 54.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.912 0.387 . . . . 0.0 110.206 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.535 ' HA ' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER 63.19 66.59 1.16 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.277 -0.874 . . . . 0.0 113.038 175.875 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -81.94 -172.11 1.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.205 1.937 . . . . 0.0 110.617 170.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.86 136.81 12.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.006 0.431 . . . . 0.0 111.023 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 49.1 t -122.39 132.44 71.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 174.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.97 104.81 0.15 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.232 0.539 . . . . 0.0 111.806 -177.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -122.71 49.92 1.57 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.214 -178.621 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 172.51 38.48 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.243 -0.979 . . . . 0.0 112.538 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.2 t0 . . . . . 0 C--O 1.243 0.735 0 CA-C-O 118.655 -0.688 . . . . 0.0 109.563 177.8 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.719 0.295 . . . . 0.0 111.305 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -89.42 101.56 14.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.039 0.447 . . . . 0.0 111.751 -177.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.49 13.8 27.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.732 0.777 . . . . 0.0 109.879 173.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.14 153.13 34.51 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.074 179.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.448 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -64.94 120.84 13.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.739 -178.975 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.66 -70.7 0.76 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 173.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.26 61.15 0.63 Allowed Glycine 0 N--CA 1.439 -1.113 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.364 177.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.8 ptp180 -130.62 8.27 4.92 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.837 0.351 . . . . 0.0 110.176 175.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.735 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 83.5 m -103.18 19.55 19.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.634 0.731 . . . . 0.0 109.486 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.84 -46.7 1.97 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.069 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.54 -54.18 46.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.84 174.08 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 149.88 175.39 22.04 Favored Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 121.058 -0.592 . . . . 0.0 111.765 -179.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.581 ' HE2' ' HA ' ' A' ' 25' ' ' CYS . 30.0 t80 -65.81 113.91 4.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.163 0.506 . . . . 0.0 111.185 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.662 HD21 ' HA ' ' A' ' 20' ' ' GLN . 0.7 OUTLIER -81.89 116.04 21.36 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.667 172.125 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.401 HG22 ' HD1' ' A' ' 13' ' ' PHE . 0.2 OUTLIER -97.85 -11.34 8.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-O 121.439 0.637 . . . . 0.0 109.398 177.324 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -33.92 37.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.38 179.184 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 3.1 mmtm -70.69 -178.64 1.9 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.167 0.508 . . . . 0.0 111.96 -174.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.82 -47.25 7.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.725 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -109.55 139.49 44.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.491 174.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.699 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -123.2 142.16 51.2 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 120.826 0.346 . . . . 0.0 111.385 -174.089 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.735 ' HB3' ' SG ' ' A' ' 9' ' ' CYS . 1.3 m -145.82 115.9 7.42 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.048 172.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.619 ' O ' ' HB3' ' A' ' 25' ' ' CYS . 21.3 t70 -156.39 -176.95 6.24 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.6 -33.92 75.97 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 166.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.63 5.24 3.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.884 178.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.619 ' HB3' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -64.33 -33.63 76.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 -179.631 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.09 -25.92 64.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.783 178.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -73.19 -34.18 65.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.942 -178.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -102.9 -16.39 15.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.673 0.273 . . . . 0.0 111.134 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 59.11 36.47 24.13 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.397 -178.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -133.07 51.84 2.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.404 -177.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.699 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -97.51 148.27 23.41 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.338 177.902 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.441 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 1.8 m -74.53 162.22 29.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.658 178.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.46 -25.19 67.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.929 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.37 12.06 9.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.66 -176.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.435 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 31.0 t80 -63.53 -50.28 70.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.558 0.694 . . . . 0.0 110.754 -176.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -29.52 62.17 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.326 -176.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.69 -54.51 18.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.089 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -84.06 -53.27 5.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 0.0 112.034 -174.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.8 m -77.7 -47.95 17.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.182 -171.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.94 73.09 0.89 Allowed Pre-proline 0 N--CA 1.465 0.316 0 O-C-N 123.541 0.525 . . . . 0.0 111.395 178.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.516 ' HB2' HG23 ' A' ' 43' ' ' VAL . 17.9 Cg_endo -60.18 -42.3 44.13 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.561 2.174 . . . . 0.0 112.223 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 56.16 36.65 27.79 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.04 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.516 HG23 ' HB2' ' A' ' 41' ' ' PRO . 35.5 t -91.58 95.14 5.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.702 -178.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.51 -51.62 16.43 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.272 0.558 . . . . 0.0 110.346 176.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -131.58 102.58 5.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.178 179.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -113.49 33.86 5.31 Favored Glycine 0 N--CA 1.454 -0.148 0 C-N-CA 121.086 -0.578 . . . . 0.0 111.751 179.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.737 0 CA-C-O 118.175 -0.917 . . . . 0.0 109.306 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 14.5 t0 . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 56.83 54.56 7.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.266 0.555 . . . . 0.0 110.534 -175.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 43.8 mp0 -78.91 -111.44 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.349 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.98 159.01 29.22 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.952 0.406 . . . . 0.0 111.2 -178.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.458 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 4.7 t -99.34 169.3 9.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.365 178.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.544 ' HG3' ' N ' ' A' ' 7' ' ' GLY . 0.5 OUTLIER 176.96 -36.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.844 175.149 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.544 ' N ' ' HG3' ' A' ' 6' ' ' LYS . . . -147.89 62.27 0.44 Allowed Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.832 -0.699 . . . . 0.0 111.955 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.613 ' HG3' ' SG ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -120.91 -40.14 2.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.99 0.424 . . . . 0.0 110.022 174.253 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 33.4 m -64.26 -19.66 65.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.256 0.551 . . . . 0.0 110.4 179.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -81.27 -15.08 56.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.64 -178.004 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.403 ' H ' ' HG2' ' A' ' 11' ' ' GLU . 0.1 OUTLIER -121.93 -4.75 9.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.738 -176.533 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.7 -175.16 51.98 Favored Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 111.321 -0.712 . . . . 0.0 111.321 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -69.4 109.74 4.34 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.224 0.535 . . . . 0.0 111.619 -177.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -92.21 102.07 14.58 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.088 169.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -78.32 47.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.962 0.886 . . . . 0.0 109.968 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -138.09 -35.42 0.63 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.771 -179.108 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.518 ' HE3' ' HA ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -71.13 166.93 20.39 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.652 -174.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.3 -37.13 16.24 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.861 -175.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -103.98 137.63 41.68 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 172.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.543 ' HB2' ' O ' ' A' ' 30' ' ' SER . 24.2 mp0 -121.63 121.79 38.16 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.243 -173.5 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.613 ' SG ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -139.57 115.45 10.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.993 0.425 . . . . 0.0 110.116 170.599 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -155.99 -175.17 5.29 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -68.75 -32.36 72.07 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 165.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.7 mt -78.68 7.39 6.96 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.816 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.17 -33.8 76.88 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -26.86 62.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.588 178.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.423 ' HD2' ' CE1' ' A' ' 28' ' ' TYR . 35.7 t80 -67.97 -43.8 78.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.607 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.423 ' CE1' ' HD2' ' A' ' 27' ' ' TYR . 93.8 m-85 -86.29 -16.06 38.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.848 0.356 . . . . 0.0 110.551 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 60.82 38.58 17.88 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.603 -178.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.543 ' O ' ' HB2' ' A' ' 20' ' ' GLN . 5.7 m -145.5 72.85 1.33 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.316 -177.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -101.09 156.94 17.12 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.164 177.161 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 58.7 m -62.88 144.94 56.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.549 175.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.91 -26.98 67.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.184 178.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.05 26.57 7.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.76 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.494 ' O ' ' HB3' ' A' ' 39' ' ' CYS . 11.6 t80 -65.93 -38.34 88.41 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.509 0.671 . . . . 0.0 109.633 -177.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.15 -33.77 63.63 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.184 178.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.61 -50.17 39.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.84 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -87.81 -45.97 9.85 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.149 -173.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.494 ' HB3' ' O ' ' A' ' 35' ' ' TYR . 35.3 t -88.28 -37.08 16.32 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.915 -0.314 . . . . 0.0 111.06 -173.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt 62.46 84.6 0.19 Allowed Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 112.659 0.615 . . . . 0.0 112.659 172.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -86.89 27.21 0.58 Allowed 'Trans proline' 0 CA--C 1.534 0.525 0 C-N-CA 123.134 2.556 . . . . 0.0 112.385 175.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -18.13 105.29 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.435 1.494 . . . . 0.0 113.626 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -80.2 141.87 14.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.02 -177.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.53 159.39 30.4 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.469 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.74 150.86 20.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.848 -178.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 131.57 -32.98 2.84 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.434 178.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 t70 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.818 -0.611 . . . . 0.0 110.189 -178.876 . . . . . . . . 0 0 . 1 stop_ save_