data_1wmv_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 1wmv _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 ' 12' ' ' LEU . . . . . 0.447 HD22 ' CD1' ' A' ' 28' ' ' PHE . 34.6 mt . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.684 0.278 . . . . 0.0 111.353 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.484 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 23.6 Cg_exo -65.61 159.38 48.44 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.87 2.38 . . . . 0.0 111.396 173.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.5 137.23 36.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 121.125 0.488 . . . . 0.0 110.128 171.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.56 -43.06 1.76 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.484 -175.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.484 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 95.2 m95 -75.94 132.87 40.52 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.943 0.719 . . . . 0.0 112.943 -175.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -114.09 142.87 45.66 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.722 174.021 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -97.4 117.1 30.89 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.3 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.571 ' O ' HG22 ' A' ' 26' ' ' VAL . 4.3 mm-40 -127.41 174.54 8.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.087 0.47 . . . . 0.0 110.478 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -132.29 140.33 48.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.082 176.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.445 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -87.84 -173.81 4.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.074 0.464 . . . . 0.0 111.068 -178.501 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.448 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -73.56 -20.89 60.51 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.593 -176.885 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.445 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 44.0 m-80 -85.95 -6.4 59.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.098 0.475 . . . . 0.0 110.395 179.142 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.25 12.82 78.19 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.757 -178.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.49 124.59 32.98 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.072 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.571 HG22 ' O ' ' A' ' 19' ' ' GLU . 2.9 p -73.6 145.63 11.33 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 120.048 -0.661 . . . . 0.0 110.381 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -148.31 159.35 44.08 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.263 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.447 ' CD1' HD22 ' A' ' 12' ' ' LEU . 18.6 m-85 -120.51 137.77 54.19 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.091 -175.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.626 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.13 118.61 37.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-O 121.38 0.609 . . . . 0.0 110.701 -178.302 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.587 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -76.27 138.71 40.73 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.948 176.0 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -109.38 23.5 14.38 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.045 0.45 . . . . 0.0 111.176 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.431 HG23 HD11 ' A' ' 32' ' ' ILE . 5.8 mm -103.07 -53.8 7.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.483 175.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.9 -22.3 15.86 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.263 175.228 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 1.0 OUTLIER 77.11 62.64 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.907 172.925 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.486 ' HG3' ' OD2' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -122.49 123.58 41.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.929 0.395 . . . . 0.0 111.311 174.936 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.626 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -87.42 119.72 27.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.108 175.015 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 6.3 t -123.76 136.68 54.57 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.15 0.5 . . . . 0.0 110.422 178.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -89.77 11.9 18.7 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.823 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.0 156.92 32.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.445 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.3 t70 . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.925 -177.829 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.516 HD12 ' CD1' ' A' ' 28' ' ' PHE . 4.2 mt . . . . . 0 C--O 1.235 0.297 0 CA-C-O 120.441 0.162 . . . . 0.0 110.89 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.562 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.5 Cg_exo -57.53 163.09 9.17 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.309 2.006 . . . . 0.0 111.546 170.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.81 -34.06 71.08 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.414 -172.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . 0.423 ' CA ' HD12 ' A' ' 32' ' ' ILE . . . -75.91 -23.74 71.28 Favored Glycine 0 CA--C 1.518 0.222 0 C-N-CA 121.083 -0.579 . . . . 0.0 113.278 -178.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.562 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 85.4 m95 -86.14 147.36 26.18 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.464 0.649 . . . . 0.0 112.654 -175.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.419 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 4.2 mm-40 -125.13 138.65 54.16 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.561 173.084 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -91.29 95.3 9.95 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.612 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.4 mm-40 -104.9 166.68 10.22 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.025 -175.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.0 m -124.72 137.65 54.33 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.565 176.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.91 -178.31 6.79 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.392 0.615 . . . . 0.0 110.814 -179.014 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -29.02 66.86 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.753 -176.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -75.02 -33.17 61.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.237 0.542 . . . . 0.0 109.738 178.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 113.6 21.25 5.83 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.934 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -96.5 131.95 42.57 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 174.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 19' ' ' GLU . 0.5 OUTLIER -78.63 151.13 5.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.504 0.668 . . . . 0.0 110.349 179.755 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -154.56 161.2 41.74 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.289 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.516 ' CD1' HD12 ' A' ' 12' ' ' LEU . 14.1 m-85 -116.58 131.69 56.88 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.281 -176.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.893 ' HB ' HG21 ' A' ' 36' ' ' THR . 0.2 OUTLIER -128.94 123.8 59.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.278 0.561 . . . . 0.0 110.917 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -72.91 119.71 17.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 171.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.419 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 38.3 m-70 -89.51 0.73 56.68 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.276 0.56 . . . . 0.0 111.295 -174.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.423 HD12 ' CA ' ' A' ' 15' ' ' GLY . 12.3 mt -105.34 -52.53 7.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.871 174.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.476 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 71.0 m-80 -89.09 6.29 40.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.937 -178.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.476 ' HG2' ' O ' ' A' ' 33' ' ' ASN . 0.0 OUTLIER 42.27 53.9 4.35 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.607 1.163 . . . . 0.0 113.61 177.695 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.543 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 8.7 mtp180 -116.01 124.07 49.57 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 122.182 -0.324 . . . . 0.0 110.322 176.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.893 HG21 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.96 112.82 26.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.405 177.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.4 t -126.21 139.71 53.13 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 120.877 0.37 . . . . 0.0 110.827 -179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -91.2 5.42 49.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.87 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.08 165.87 14.71 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.883 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.8 t0 . . . . . 0 C--N 1.327 -0.399 0 O-C-N 123.4 0.438 . . . . 0.0 110.491 -178.456 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.639 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 0.1 OUTLIER . . . . . 0 CA--C 1.515 -0.381 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.576 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 32.4 Cg_exo -57.24 167.46 3.44 Favored 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.315 2.01 . . . . 0.0 111.187 169.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -55.94 -37.48 69.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.057 -174.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -78.42 -23.73 64.69 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.647 -0.787 . . . . 0.0 113.113 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.639 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 92.6 m95 -87.9 144.58 26.49 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -173.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.438 ' HB2' ' HD2' ' A' ' 31' ' ' HIS . 1.8 mm-40 -130.26 146.48 51.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.664 176.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.2 tt0 -97.43 104.38 16.39 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.985 0.422 . . . . 0.0 110.432 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.62 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.2 mt-10 -114.18 165.23 12.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.017 -178.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.43 145.37 44.18 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.933 0.397 . . . . 0.0 110.567 177.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.04 -177.93 6.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.975 0.416 . . . . 0.0 110.353 179.158 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.435 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -65.68 -28.16 68.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.668 -175.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -85.18 -46.12 11.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.159 0.504 . . . . 0.0 110.737 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.69 12.15 0.8 Allowed Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.899 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.48 133.67 34.46 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 175.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.5 p -86.16 153.93 3.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.428 0.632 . . . . 0.0 110.983 -178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.62 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 54.4 p90 -155.29 163.0 40.73 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.834 -1.075 . . . . 0.0 109.263 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.428 ' CE2' ' HA ' ' A' ' 40' ' ' ASP . 11.4 m-85 -118.92 137.87 53.17 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.826 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.761 ' HB ' HG21 ' A' ' 36' ' ' THR . 0.1 OUTLIER -130.75 125.06 57.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 121.162 0.505 . . . . 0.0 111.269 -178.047 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -76.68 99.26 5.0 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 173.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.438 ' HD2' ' HB2' ' A' ' 17' ' ' GLU . 30.8 m-70 -75.82 -7.43 54.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.698 0.285 . . . . 0.0 111.193 -172.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 46.6 mm -63.29 -48.94 85.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.124 0.488 . . . . 0.0 110.317 176.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.69 2.47 14.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.598 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.49 ' N ' ' HE3' ' A' ' 34' ' ' LYS . 0.0 OUTLIER 60.61 62.99 1.4 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.588 176.307 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -122.84 125.34 45.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.753 0.311 . . . . 0.0 110.376 173.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.761 HG21 ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -97.7 120.56 38.3 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.944 -178.707 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.8 t -126.37 139.28 53.4 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.152 0.501 . . . . 0.0 110.441 176.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -85.63 -12.05 52.37 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.368 0.604 . . . . 0.0 110.027 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.53 149.67 26.46 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.348 179.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.428 ' HA ' ' CE2' ' A' ' 28' ' ' PHE . 0.8 OUTLIER . . . . . 0 N--CA 1.437 -1.089 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.166 -176.011 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.512 HD22 ' CD1' ' A' ' 28' ' ' PHE . 7.0 mt . . . . . 0 C--O 1.234 0.272 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.46 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.0 Cg_exo -58.82 174.67 0.77 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.455 2.77 . . . . 0.0 112.319 170.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -64.77 -41.09 96.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.403 -175.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.34 -25.25 75.64 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.882 -0.675 . . . . 0.0 113.256 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.46 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 92.1 m95 -87.57 142.94 27.46 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.412 0.625 . . . . 0.0 112.601 -175.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.37 154.06 34.19 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.063 174.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -105.23 101.88 11.4 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.619 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.3 mm-40 -113.17 165.52 12.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.678 -175.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.7 m -116.45 138.25 51.52 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.794 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.78 178.6 7.24 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 121.343 0.592 . . . . 0.0 110.506 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.417 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.5 OUTLIER -59.68 -39.58 84.98 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.125 -177.239 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -73.08 -49.59 27.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.778 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 139.42 10.88 0.79 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.974 -0.631 . . . . 0.0 112.033 -178.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -85.66 143.17 28.56 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 19' ' ' GLU . 1.4 p -86.35 156.7 3.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.233 0.539 . . . . 0.0 111.052 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.485 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 45.9 p90 -158.85 161.91 36.91 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.608 178.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.512 ' CD1' HD22 ' A' ' 12' ' ' LEU . 12.9 m-85 -116.97 132.52 56.68 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.442 -176.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.619 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -130.02 130.0 65.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.836 179.017 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.49 132.4 36.32 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 172.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.0 m-70 -100.77 15.76 27.27 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.251 -0.58 . . . . 0.0 111.666 -173.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.2 mt -99.01 -54.27 7.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.078 173.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 34' ' ' LYS . 2.7 m-80 -95.15 -15.97 22.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.249 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 33' ' ' ASN . 0.4 OUTLIER 74.31 39.49 0.47 Allowed 'General case' 0 N--CA 1.464 0.271 0 O-C-N 124.191 0.932 . . . . 0.0 111.529 177.796 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 58.5 mtp180 -89.8 136.01 33.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.86 0.362 . . . . 0.0 110.538 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.468 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.4 OUTLIER -115.89 118.06 31.93 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.377 -178.74 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.3 t -125.46 131.94 52.78 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.004 0.431 . . . . 0.0 110.263 176.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -88.91 0.08 56.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.46 0.647 . . . . 0.0 109.926 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.92 163.45 15.54 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.031 176.465 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.3 t0 . . . . . 0 C--N 1.324 -0.542 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.715 -178.236 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.511 HD21 ' CD1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 120.505 0.193 . . . . 0.0 111.318 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.522 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 72.4 Cg_exo -52.53 168.62 0.42 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.137 2.558 . . . . 0.0 112.033 168.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -64.89 -38.36 90.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.165 -173.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.73 -27.04 71.48 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.056 -0.593 . . . . 0.0 113.05 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.522 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 94.2 m95 -85.21 141.94 29.79 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -176.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -124.29 138.75 54.36 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.92 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.653 HE21 ' HE1' ' A' ' 28' ' ' PHE . 8.7 tt0 -88.08 100.6 13.06 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.265 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.574 ' O ' HG23 ' A' ' 26' ' ' VAL . 3.3 mm-40 -100.96 172.23 7.15 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.506 -178.171 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 m -134.25 134.69 42.27 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.33 174.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.6 -174.28 5.19 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.527 -175.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.468 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -70.58 -31.58 68.64 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.311 -177.44 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -76.17 -25.65 55.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.36 0.6 . . . . 0.0 109.903 178.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 105.95 12.07 26.75 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.769 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.97 144.19 30.16 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 174.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 19' ' ' GLU . 1.1 p -86.94 153.87 3.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-O 121.145 0.498 . . . . 0.0 110.25 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -159.41 156.69 28.87 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.171 178.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.653 ' HE1' HE21 ' A' ' 18' ' ' GLN . 11.3 m-85 -113.18 132.72 55.37 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.012 -175.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.801 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -125.41 123.54 65.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-O 121.474 0.654 . . . . 0.0 111.169 -179.145 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.588 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 12.1 t0 -77.38 133.57 38.66 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.528 172.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.4 m-70 -100.84 -2.84 31.11 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 120.711 0.291 . . . . 0.0 111.271 -174.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.2 mt -88.09 -61.72 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 120.899 0.381 . . . . 0.0 110.304 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.521 ' C ' ' HG2' ' A' ' 34' ' ' LYS . 3.1 p30 -106.91 23.25 14.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.102 0.477 . . . . 0.0 110.615 178.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.588 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.0 OUTLIER 38.1 75.38 0.07 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.799 1.24 . . . . 0.0 113.894 173.499 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.462 ' HD3' ' CH2' ' A' ' 16' ' ' TRP . 0.0 OUTLIER -122.23 119.41 31.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.715 0.293 . . . . 0.0 110.401 172.944 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.801 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -99.83 113.99 26.87 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.195 178.01 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.7 t -126.33 132.87 51.52 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.391 0.139 . . . . 0.0 110.735 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -76.6 -26.89 55.48 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.212 0.53 . . . . 0.0 110.306 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.26 168.82 8.93 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.357 -178.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 13.5 t70 . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.052 -176.901 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.427 HD22 ' CD1' ' A' ' 28' ' ' PHE . 0.5 OUTLIER . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.584 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 42.9 Cg_exo -56.53 158.11 16.9 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 121.874 1.716 . . . . 0.0 110.911 169.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -36.73 70.01 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.101 -0.499 . . . . 0.0 112.072 -171.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.32 -30.37 75.3 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.877 -0.677 . . . . 0.0 113.249 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.584 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 86.6 m95 -81.39 130.38 35.02 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -173.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.409 ' HA ' ' OE1' ' A' ' 17' ' ' GLU . 4.9 mm-40 -114.25 150.98 33.55 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.015 174.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -96.7 104.62 16.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.821 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.592 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 0.8 OUTLIER -115.63 166.2 12.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.137 0.494 . . . . 0.0 110.64 -176.94 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.03 139.89 53.4 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.587 174.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.415 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -81.3 -179.07 7.2 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.382 0.61 . . . . 0.0 110.713 -179.273 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.33 -11.51 60.73 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.013 -173.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.415 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 29.5 m-80 -101.81 -6.32 23.75 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.056 0.455 . . . . 0.0 110.252 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 91.12 16.11 54.56 Favored Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.969 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -89.46 125.45 35.18 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 175.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.477 HG22 ' O ' ' A' ' 19' ' ' GLU . 6.0 p -75.89 150.96 6.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.471 0.653 . . . . 0.0 110.992 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.432 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 41.1 p90 -156.17 158.53 37.79 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.541 -1.208 . . . . 0.0 108.76 176.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.427 ' CD1' HD22 ' A' ' 12' ' ' LEU . 30.3 m-85 -119.01 136.59 54.04 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.507 -176.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.981 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -133.27 124.28 48.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.482 0.658 . . . . 0.0 111.979 -176.509 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.443 ' HB2' ' CE2' ' A' ' 16' ' ' TRP . 50.4 t0 -74.05 109.58 7.66 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.308 171.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 43.2 m-70 -82.52 -1.54 50.81 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.07 0.462 . . . . 0.0 111.101 -175.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.8 mm -97.03 -52.94 8.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.835 176.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -90.7 -5.42 55.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.159 -178.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 62.15 61.29 1.35 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.455 176.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.631 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -123.8 118.94 28.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.688 177.102 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.981 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.01 109.41 21.4 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.483 176.433 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.8 t -123.85 136.76 54.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.189 0.519 . . . . 0.0 110.72 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -83.71 5.2 25.52 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.257 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.32 152.89 28.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.77 0.319 . . . . 0.0 110.639 179.05 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 17.4 t0 . . . . . 0 C--N 1.325 -0.489 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.343 -174.43 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.453 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 49.3 mt . . . . . 0 N--CA 1.446 -0.643 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.578 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 49.9 Cg_exo -56.29 163.53 6.32 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 121.759 1.639 . . . . 0.0 110.925 174.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -55.6 -38.3 69.25 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.949 -170.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -76.29 -25.32 66.28 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.147 -0.549 . . . . 0.0 114.323 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.578 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 88.5 m95 -83.99 143.55 29.72 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -172.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.415 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -121.15 149.54 42.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.634 173.595 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -98.82 103.09 15.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.107 0.479 . . . . 0.0 109.769 179.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.429 ' O ' HG21 ' A' ' 26' ' ' VAL . 7.3 mm-40 -105.31 167.22 9.88 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.143 -177.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.9 m -134.57 138.8 44.89 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.077 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.432 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -78.18 172.29 13.78 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 121.349 0.595 . . . . 0.0 109.47 178.185 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -72.47 -10.37 59.7 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.771 -172.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.432 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 35.5 m-80 -100.05 -1.59 36.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.265 0.555 . . . . 0.0 110.004 178.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 90.55 15.45 56.85 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.564 -0.744 . . . . 0.0 113.252 176.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -88.2 120.9 30.0 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 173.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.429 HG21 ' O ' ' A' ' 19' ' ' GLU . 0.8 OUTLIER -74.68 154.01 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.389 0.614 . . . . 0.0 110.829 -178.847 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -160.75 155.26 23.51 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.293 176.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.414 ' CD1' HD12 ' A' ' 12' ' ' LEU . 19.8 m-85 -113.12 136.98 52.12 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.951 -175.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.857 ' HB ' HG22 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.74 122.35 49.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.242 0.544 . . . . 0.0 111.087 -177.816 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.477 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -76.0 128.16 34.47 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 172.942 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.415 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 67.4 m-70 -99.05 15.07 27.03 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.806 0.336 . . . . 0.0 111.317 -175.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 21.9 mm -91.49 -55.52 6.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.085 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -120.64 3.01 10.69 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.5 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.0 OUTLIER 73.61 79.42 0.13 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.454 -0.793 . . . . 0.0 112.611 170.199 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.662 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -122.77 118.27 27.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.293 173.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.857 HG22 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.78 114.71 29.02 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.172 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.2 t -126.25 134.13 51.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.658 0.266 . . . . 0.0 110.772 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -79.26 -17.83 53.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.142 0.496 . . . . 0.0 110.971 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.4 159.34 16.22 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.589 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.3 t70 . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.753 -176.742 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.515 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 84.2 mt . . . . . 0 N--CA 1.449 -0.508 0 N-CA-C 110.394 -0.225 . . . . 0.0 110.394 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.568 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 36.5 Cg_exo -63.63 177.4 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.393 2.062 . . . . 0.0 112.465 173.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -58.39 -39.05 78.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.766 -171.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -90.99 -15.64 55.81 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.56 -0.829 . . . . 0.0 113.909 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.568 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 85.3 m95 -89.22 139.47 30.45 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -171.045 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -120.36 132.13 55.14 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.853 174.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -80.84 104.48 11.38 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 176.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.55 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.0 OUTLIER -114.93 164.5 14.05 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.371 -178.422 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 18.2 m -129.27 138.81 51.85 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.4 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.18 178.71 3.7 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.504 0.668 . . . . 0.0 110.946 -177.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.468 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -68.15 -19.94 64.85 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.864 -173.307 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -93.06 -43.81 8.7 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.443 -178.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 139.05 18.5 0.51 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.665 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.494 ' HB3' ' HE2' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -90.63 126.96 36.13 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 175.462 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -79.79 153.83 4.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 120.283 -0.567 . . . . 0.0 110.743 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.7 p90 -162.97 158.72 22.63 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.843 178.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -116.94 138.08 51.79 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.514 -177.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 1.013 ' HB ' HG22 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.8 124.35 53.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.364 0.602 . . . . 0.0 111.411 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -74.31 107.76 6.67 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 170.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -82.52 1.19 39.03 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.159 0.504 . . . . 0.0 111.117 -174.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.3 mm -97.73 -55.38 6.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.351 0.596 . . . . 0.0 109.623 176.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -92.56 -1.12 57.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.379 -176.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm 59.6 61.51 1.96 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.692 175.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.586 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -124.07 117.78 25.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.611 175.647 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 1.013 HG22 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -103.72 114.11 28.12 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.289 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.3 t -125.54 132.42 52.59 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.976 0.417 . . . . 0.0 110.746 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.494 ' HE2' ' HB3' ' A' ' 25' ' ' GLN . 26.0 m-85 -83.75 -4.91 59.01 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.764 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.501 HD12 ' H ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -115.54 172.08 7.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.436 175.942 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.501 ' H ' HD12 ' A' ' 39' ' ' LEU . 10.1 t70 . . . . . 0 C--N 1.325 -0.5 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.282 -174.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.507 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 43.9 mt . . . . . 0 N--CA 1.456 -0.175 0 CA-C-O 120.725 0.298 . . . . 0.0 111.436 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.513 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 50.7 Cg_exo -59.39 173.9 1.27 Allowed 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 123.366 2.711 . . . . 0.0 112.348 170.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.4 -41.72 94.46 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.034 -175.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -74.48 -28.89 62.68 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.613 -177.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.513 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 91.6 m95 -83.84 134.53 34.7 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.252 0.549 . . . . 0.0 112.394 -173.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -119.35 143.09 47.59 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.563 174.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -94.34 106.76 18.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.922 0.391 . . . . 0.0 109.997 -177.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.556 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.5 mt-10 -114.85 167.8 10.46 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.373 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.2 m -124.29 136.63 54.27 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.173 175.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.1 177.32 9.03 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.099 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -64.92 -35.01 79.77 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.245 -176.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -67.05 -37.72 84.54 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.301 0.572 . . . . 0.0 109.82 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 116.6 15.96 6.68 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.343 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -87.69 137.69 32.12 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 173.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.491 HG21 ' O ' ' A' ' 19' ' ' GLU . 2.9 p -84.26 145.5 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 120.015 -0.674 . . . . 0.0 109.938 178.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.514 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.2 p90 -147.18 155.49 42.16 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.502 -179.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.417 ' O ' HG23 ' A' ' 37' ' ' THR . 17.9 m-85 -114.35 132.17 56.29 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.872 -174.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 1.063 ' HB ' HG21 ' A' ' 36' ' ' THR . 0.1 OUTLIER -131.07 120.3 46.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-O 121.142 0.496 . . . . 0.0 110.85 -179.122 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.478 ' HB3' ' HD3' ' A' ' 35' ' ' ARG . 4.6 t0 -78.7 112.68 16.06 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 171.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.6 m-70 -82.82 -10.15 58.99 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.043 -172.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.0 mm -75.32 -56.54 8.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.915 ' HB2' ' HD2' ' A' ' 35' ' ' ARG . 61.9 m-80 -93.57 -5.08 49.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.599 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.5 mmtm 62.82 61.69 1.13 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.832 176.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.915 ' HD2' ' HB2' ' A' ' 33' ' ' ASN . 0.8 OUTLIER -122.74 123.34 40.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.56 176.3 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 1.063 HG21 ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -105.23 117.41 33.93 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.692 179.809 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.417 HG23 ' O ' ' A' ' 28' ' ' PHE . 1.8 t -125.49 130.97 52.84 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.892 0.377 . . . . 0.0 110.247 177.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.508 ' HA ' ' CB ' ' A' ' 27' ' ' PHE . 11.2 m-85 -78.53 -17.25 56.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.023 -177.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -112.88 166.47 11.36 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 120.87 0.366 . . . . 0.0 111.009 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.7 t0 . . . . . 0 C--N 1.324 -0.501 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.695 -177.281 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.41 HD11 ' CD1' ' A' ' 28' ' ' PHE . 17.1 mt . . . . . 0 N--CA 1.452 -0.366 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.498 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 76.8 Cg_exo -55.21 177.86 0.1 Allowed 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.6 2.867 . . . . 0.0 112.885 172.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -65.07 -43.12 93.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.54 -176.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.37 -28.94 72.02 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.249 -0.501 . . . . 0.0 112.613 -176.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.498 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 92.8 m95 -83.74 146.91 27.93 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -129.32 138.54 51.64 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.321 175.09 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -93.13 101.18 13.47 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.582 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 2.0 mt-10 -106.1 164.06 12.29 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.053 -178.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 12.7 m -125.65 134.28 51.92 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.018 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.67 172.94 10.5 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 121.269 0.556 . . . . 0.0 110.053 179.021 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.93 -27.14 67.95 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.484 -173.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -76.98 -36.89 56.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.311 0.577 . . . . 0.0 109.68 177.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 126.79 7.6 5.07 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.891 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -78.02 116.43 18.5 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 176.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.2 p -74.14 154.76 6.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-O 121.176 0.513 . . . . 0.0 110.209 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.521 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 51.9 p90 -164.74 159.76 19.02 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.542 -0.753 . . . . 0.0 110.416 -177.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.41 ' CD1' HD11 ' A' ' 12' ' ' LEU . 6.9 m-85 -114.39 130.66 56.71 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.71 -176.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.868 ' HB ' HG22 ' A' ' 36' ' ' THR . 0.1 OUTLIER -130.93 127.57 61.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 121.174 0.512 . . . . 0.0 110.08 176.816 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.654 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -75.38 136.17 40.78 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 173.762 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.4 m-70 -107.63 28.67 7.94 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.26 0.553 . . . . 0.0 111.429 -176.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.3 mm -107.95 -54.91 5.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 171.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.491 ' O ' ' HB2' ' A' ' 34' ' ' LYS . 59.3 m-80 -95.13 -28.51 15.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.835 177.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.654 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.1 OUTLIER 79.49 53.21 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.237 174.12 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.38 131.76 54.77 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.448 174.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.868 HG22 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -96.5 125.81 41.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.852 -178.271 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.7 t -125.77 138.17 53.84 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.928 0.394 . . . . 0.0 110.104 175.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -89.16 -8.18 54.19 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.531 178.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.51 157.51 21.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.39 179.186 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.2 t70 . . . . . 0 C--N 1.325 -0.496 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.6 -177.091 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.487 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 24.3 mt . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.926 0.393 . . . . 0.0 111.474 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.542 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 32.6 Cg_exo -61.27 169.87 5.85 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.167 2.578 . . . . 0.0 112.515 174.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.59 -40.03 62.23 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.335 -0.848 . . . . 0.0 113.169 -173.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -83.33 -12.3 78.93 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.39 -0.909 . . . . 0.0 113.68 -175.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.542 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 87.6 m95 -92.27 137.97 31.92 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -172.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -120.45 141.69 49.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.542 174.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.718 HE21 ' HE1' ' A' ' 28' ' ' PHE . 20.4 tt0 -92.84 104.2 16.48 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.537 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.7 mt-10 -114.67 168.63 9.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.648 -176.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.24 140.57 51.86 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.205 176.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.428 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -77.53 -176.56 4.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.191 0.52 . . . . 0.0 110.349 179.846 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.7 -26.37 66.14 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.427 -176.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.428 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 16.6 m-80 -84.44 -43.16 14.91 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.083 0.468 . . . . 0.0 110.842 -178.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 131.2 16.5 1.54 Allowed Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.906 -0.664 . . . . 0.0 111.854 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.0 126.96 35.64 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 174.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.405 HG22 ' O ' ' A' ' 19' ' ' GLU . 1.0 OUTLIER -80.05 152.1 4.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.352 0.596 . . . . 0.0 110.849 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.537 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 54.1 p90 -157.63 166.03 33.94 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.704 -178.092 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.718 ' HE1' HE21 ' A' ' 18' ' ' GLN . 7.7 m-85 -118.34 134.96 54.61 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.703 -179.061 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.531 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -129.45 124.94 60.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-O 121.138 0.494 . . . . 0.0 111.0 -179.828 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.616 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 2.6 t0 -73.56 114.06 11.38 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 171.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -86.99 0.27 55.45 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.749 -0.38 . . . . 0.0 112.012 -172.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -79.42 -49.51 19.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -101.16 -11.39 19.59 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.279 -178.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.67 58.98 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.181 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.616 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -122.29 125.68 46.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.689 179.27 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -96.93 129.35 44.39 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.001 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.1 t -125.51 132.22 52.67 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 172.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -93.02 0.05 57.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.453 0.644 . . . . 0.0 109.998 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -116.65 159.53 22.06 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.26 173.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.1 t70 . . . . . 0 C--N 1.319 -0.731 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.653 -174.814 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.9 mt . . . . . 0 N--CA 1.45 -0.469 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.543 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.9 Cg_exo -56.17 173.26 0.46 Allowed 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.844 2.362 . . . . 0.0 112.251 172.115 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.443 ' CE2' HD12 ' A' ' 32' ' ' ILE . 0.9 OUTLIER -61.46 -39.38 90.66 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.837 -173.131 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -75.92 -24.7 68.7 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.919 -0.657 . . . . 0.0 114.062 -175.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.543 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 88.2 m95 -82.42 138.2 34.49 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -171.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.435 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -118.19 153.56 33.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.834 175.369 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -107.79 106.63 17.01 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.468 178.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.494 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.1 mt-10 -110.78 178.55 4.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.436 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.436 HG21 ' HA2' ' A' ' 24' ' ' GLY . 0.2 OUTLIER -126.19 138.13 53.62 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.477 179.398 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.507 ' OD1' ' HG3' ' A' ' 22' ' ' GLU . 0.8 OUTLIER -107.86 179.24 4.28 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 -179.056 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.507 ' HG3' ' OD1' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -26.4 -78.6 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -166.767 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -88.35 35.44 0.76 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.166 0.507 . . . . 0.0 111.915 -170.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.436 ' HA2' HG21 ' A' ' 20' ' ' THR . . . 82.51 4.84 89.97 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.888 -0.672 . . . . 0.0 111.486 178.164 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -61.14 113.93 2.85 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.36 -0.42 . . . . 0.0 109.917 177.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.3 p -78.7 153.25 4.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.201 0.524 . . . . 0.0 110.752 -179.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.494 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 53.9 p90 -157.94 161.18 38.19 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.906 177.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -116.97 137.13 52.42 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.089 -175.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.662 ' HB ' HG21 ' A' ' 36' ' ' THR . 0.2 OUTLIER -129.54 121.03 52.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.342 0.591 . . . . 0.0 111.344 -178.652 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.689 ' HB3' ' HG2' ' A' ' 35' ' ' ARG . 43.0 t0 -78.31 117.22 19.34 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.722 -1.127 . . . . 0.0 108.958 177.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.435 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 73.7 m-70 -89.39 -4.07 58.19 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.815 0.34 . . . . 0.0 111.17 -176.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.443 HD12 ' CE2' ' A' ' 14' ' ' TYR . 17.7 mm -95.79 -42.79 12.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.195 0.521 . . . . 0.0 110.048 175.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.514 ' CB ' ' HD3' ' A' ' 35' ' ' ARG . 69.5 m-80 -98.13 -7.43 29.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.002 -179.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.01 51.59 2.8 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.404 173.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.689 ' HG2' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -125.9 142.3 51.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.679 0.276 . . . . 0.0 111.472 177.026 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.662 HG21 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -111.15 119.17 38.07 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.262 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 39' ' ' LEU . 15.3 t -125.25 137.7 54.1 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.056 0.455 . . . . 0.0 110.891 178.576 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -91.65 3.81 54.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.898 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.417 ' O ' HG22 ' A' ' 37' ' ' THR . 0.6 OUTLIER -119.92 163.92 16.84 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.832 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.7 t70 . . . . . 0 C--N 1.323 -0.568 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.567 -177.806 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.755 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--O 1.235 0.304 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.443 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 47.4 Cg_exo -60.6 -168.73 0.05 OUTLIER 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.826 3.017 . . . . 0.0 112.475 169.376 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.45 -45.32 72.83 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.011 -174.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -82.02 -21.96 60.19 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.64 -0.791 . . . . 0.0 113.157 -175.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.755 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 85.6 m95 -83.28 144.89 29.42 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -171.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.413 ' HB2' ' HD2' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -124.73 146.83 48.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.115 174.185 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.498 ' HB2' ' CD2' ' A' ' 12' ' ' LEU . 28.0 tt0 -100.6 100.96 11.75 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.599 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 5.0 mt-10 -108.91 168.17 9.55 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.102 0.477 . . . . 0.0 110.99 -175.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -114.28 137.62 51.56 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.549 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -176.14 4.92 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.097 0.475 . . . . 0.0 110.677 -179.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -70.45 -30.0 66.72 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.248 -175.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -78.34 -43.77 26.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.185 0.517 . . . . 0.0 109.764 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 128.74 25.78 0.99 Allowed Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.998 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.7 149.36 23.4 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 174.061 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.443 HG21 ' O ' ' A' ' 19' ' ' GLU . 1.4 p -90.49 156.07 3.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.35 0.595 . . . . 0.0 110.653 -179.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.599 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 46.0 p90 -161.05 163.72 31.37 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.592 178.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.442 ' CD1' HD21 ' A' ' 12' ' ' LEU . 14.3 m-85 -117.2 131.42 56.87 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.484 -176.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.862 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.46 122.04 46.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.329 0.585 . . . . 0.0 110.791 179.519 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.532 ' HA ' ' HA ' ' A' ' 16' ' ' TRP . 0.0 OUTLIER -77.83 126.62 31.12 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 172.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.413 ' HD2' ' HB2' ' A' ' 17' ' ' GLU . 64.5 m-70 -99.56 9.5 43.08 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.39 -174.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.472 HD11 HG23 ' A' ' 32' ' ' ILE . 3.5 mm -94.2 -49.34 12.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.093 0.473 . . . . 0.0 109.891 175.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -108.96 -1.52 18.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.648 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm 64.72 65.41 0.62 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 170.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.589 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -123.72 134.12 53.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.565 0.222 . . . . 0.0 111.094 173.856 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.862 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -112.1 118.75 36.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.664 179.413 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.8 t -125.98 136.84 53.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.775 0.321 . . . . 0.0 110.517 176.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -87.28 -7.23 58.08 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.062 0.458 . . . . 0.0 110.659 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.8 164.42 13.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.759 176.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.7 t70 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.858 -176.704 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.603 HD13 ' HB2' ' A' ' 18' ' ' GLN . 14.5 mt . . . . . 0 N--CA 1.427 -1.596 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.53 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 26.9 Cg_exo -63.15 168.26 11.16 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.479 2.119 . . . . 0.0 112.065 178.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.53 -39.45 80.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.688 -174.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -80.22 -20.79 66.39 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.553 -0.832 . . . . 0.0 113.047 -176.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.53 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 79.8 m95 -86.24 138.95 31.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.402 0.62 . . . . 0.0 112.36 -176.362 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -122.8 143.59 49.74 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.011 175.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.603 ' HB2' HD13 ' A' ' 12' ' ' LEU . 8.4 tt0 -93.42 110.55 22.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.074 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.64 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 2.3 mt-10 -119.92 165.28 14.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.515 -178.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.3 m -121.61 133.89 55.0 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.573 177.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.77 -177.8 6.81 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.255 0.55 . . . . 0.0 111.075 -176.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.97 -18.06 62.02 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.931 -174.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -88.5 -8.36 54.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.339 0.59 . . . . 0.0 109.563 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.1 19.05 58.24 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.06 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -97.44 135.63 39.03 Favored 'General case' 0 N--CA 1.438 -1.038 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 176.194 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 19' ' ' GLU . 2.0 p -78.47 151.01 5.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.717 0.77 . . . . 0.0 111.084 -179.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.64 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 50.8 p90 -150.84 160.85 43.61 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.135 177.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -116.55 137.93 51.8 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.642 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.53 126.52 55.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 CA-C-O 121.294 0.568 . . . . 0.0 111.492 -179.079 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.537 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 4.8 t70 -77.33 123.61 26.73 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.914 -1.039 . . . . 0.0 108.46 172.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 73.1 m-70 -98.73 9.11 44.06 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.322 -175.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.477 HD11 HG23 ' A' ' 32' ' ' ILE . 13.6 mm -91.27 -57.03 4.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.911 178.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.61 1.5 19.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.177 178.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.537 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 12.2 mptt 67.03 72.47 0.36 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.317 -0.856 . . . . 0.0 113.084 168.381 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.452 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.2 OUTLIER -123.84 120.31 32.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.573 172.172 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.642 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -97.57 117.1 31.07 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.235 176.309 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.7 t -125.63 131.9 52.58 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.856 0.36 . . . . 0.0 110.761 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -79.87 -15.7 56.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.373 0.606 . . . . 0.0 109.699 178.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -102.52 161.5 13.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.834 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 55.5 t0 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.349 -175.114 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.455 HD11 ' CD1' ' A' ' 28' ' ' PHE . 0.8 OUTLIER . . . . . 0 N--CA 1.452 -0.337 0 CA-C-O 120.674 0.273 . . . . 0.0 111.615 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.5 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 72.9 Cg_exo -54.75 173.65 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 123.17 2.58 . . . . 0.0 112.551 170.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -65.15 -39.84 93.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.196 -174.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.15 -28.82 73.21 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.398 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.5 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 89.6 m95 -83.66 122.0 28.03 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.935 0.716 . . . . 0.0 112.935 -174.271 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -101.87 130.51 48.36 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.009 174.131 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.453 ' HB2' HD12 ' A' ' 12' ' ' LEU . 54.4 tt0 -85.01 100.19 11.5 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.039 0.447 . . . . 0.0 110.191 177.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.592 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 2.0 mm-40 -106.91 173.62 6.24 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.732 -176.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 8.0 m -126.39 139.45 53.26 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.241 175.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.437 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -83.74 177.51 8.33 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.17 0.51 . . . . 0.0 110.296 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.41 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -70.71 -23.69 62.51 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.368 -174.978 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.437 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 41.1 m-80 -83.96 -11.28 57.08 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.241 0.543 . . . . 0.0 110.39 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 95.48 12.51 53.82 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.473 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -81.57 139.56 35.0 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 174.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -86.45 149.37 4.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.854 176.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.413 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 44.1 p90 -157.54 158.13 35.08 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.095 -0.957 . . . . 0.0 109.984 -179.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.455 ' CD1' HD11 ' A' ' 12' ' ' LEU . 10.5 m-85 -114.97 131.98 56.73 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.205 -175.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 1.039 ' HB ' HG21 ' A' ' 36' ' ' THR . 0.1 OUTLIER -129.35 120.53 51.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-O 121.614 0.721 . . . . 0.0 111.113 178.532 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -73.01 120.72 19.03 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.545 173.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -93.75 1.38 56.53 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.897 0.38 . . . . 0.0 110.463 -178.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.44 HD13 HG22 ' A' ' 32' ' ' ILE . 6.2 mm -101.81 -51.92 8.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.382 0.611 . . . . 0.0 109.632 175.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -89.11 -11.18 44.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.725 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.433 ' HD2' ' HA ' ' A' ' 34' ' ' LYS . 2.6 mmmm 62.64 57.08 1.87 Allowed 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.266 0.626 . . . . 0.0 112.564 175.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.563 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -124.57 125.68 44.57 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.303 175.638 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 1.039 HG21 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -102.08 115.64 30.98 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 174.562 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.6 t -126.09 134.44 51.37 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.803 0.335 . . . . 0.0 110.581 177.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -84.2 -4.38 58.78 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.04 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -121.61 166.7 13.83 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.96 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.7 t0 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.901 -179.951 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.608 HD12 ' CD1' ' A' ' 28' ' ' PHE . 19.9 mt . . . . . 0 N--CA 1.454 -0.261 0 CA-C-O 120.319 0.104 . . . . 0.0 111.025 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.544 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 51.0 Cg_exo -57.28 168.33 2.86 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 122.911 2.408 . . . . 0.0 112.312 174.093 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.86 -39.23 68.41 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.736 -0.665 . . . . 0.0 112.212 -174.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . 0.466 ' CA ' HD12 ' A' ' 32' ' ' ILE . . . -77.98 -22.73 68.08 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.4 -176.156 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.544 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 92.0 m95 -88.41 131.0 35.03 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -173.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.416 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 15.7 mm-40 -112.61 140.06 47.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.34 174.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.656 HE21 ' HE1' ' A' ' 28' ' ' PHE . 32.3 tt0 -93.27 104.16 16.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.028 0.442 . . . . 0.0 110.164 179.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 4.1 mt-10 -109.81 168.45 9.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.713 -177.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.8 m -125.63 134.02 52.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.127 175.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.13 -176.51 5.16 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.188 0.518 . . . . 0.0 110.865 -177.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.42 -32.41 73.27 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.472 -177.42 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -77.75 -23.58 49.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.265 0.555 . . . . 0.0 110.276 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 104.26 14.88 23.09 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.512 -178.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -84.76 137.95 32.9 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 174.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.1 p -84.88 153.96 3.58 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-O 121.476 0.655 . . . . 0.0 110.229 177.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 50.0 p90 -160.19 161.65 33.64 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.47 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.656 ' HE1' HE21 ' A' ' 18' ' ' GLN . 12.5 m-85 -119.38 135.99 54.48 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.388 -176.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.836 ' HB ' HG21 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.1 121.97 50.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.691 179.871 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.798 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 7.0 t0 -75.1 118.61 18.24 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 171.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.416 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 28.0 m-70 -87.52 -4.22 58.98 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -171.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.466 HD12 ' CA ' ' A' ' 15' ' ' GLY . 4.4 mt -86.96 -42.79 15.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.947 0.403 . . . . 0.0 110.378 176.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.4 m-80 -101.95 -5.74 24.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.077 179.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.44 58.94 3.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.06 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.798 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 1.3 ptt180 -121.57 121.01 36.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.745 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.836 HG21 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -101.78 120.71 40.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.928 -178.813 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.6 t -126.11 137.83 53.63 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.693 0.282 . . . . 0.0 110.486 175.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -89.15 -3.83 58.48 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.21 0.528 . . . . 0.0 109.976 177.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.17 156.85 18.03 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.989 175.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.5 t0 . . . . . 0 C--N 1.322 -0.614 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.213 -175.54 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.469 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 35.3 mt . . . . . 0 N--CA 1.455 -0.204 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.516 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 31.3 Cg_exo -61.09 -172.47 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 123.357 2.704 . . . . 0.0 113.336 176.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -54.56 45.68 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.416 -172.366 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -78.23 -17.26 78.39 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.615 -0.721 . . . . 0.0 113.315 -173.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.516 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 92.6 m95 -85.35 133.65 34.13 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.514 0.673 . . . . 0.0 112.735 -170.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -120.42 135.9 54.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.578 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -85.12 109.44 18.26 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.602 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.1 mm-40 -118.35 166.99 11.98 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.421 -176.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.8 m -127.69 135.38 50.11 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.87 173.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.73 -178.23 5.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.369 0.604 . . . . 0.0 110.917 -177.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -32.08 73.38 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.309 -175.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -74.29 -41.66 60.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.436 0.636 . . . . 0.0 110.303 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 125.91 14.05 3.18 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.713 -179.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.39 127.5 34.39 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 175.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.411 HG21 ' O ' ' A' ' 19' ' ' GLU . 0.5 OUTLIER -79.17 151.69 4.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.348 0.594 . . . . 0.0 110.228 178.597 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.5 p90 -162.09 160.61 27.57 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.518 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -115.25 135.62 53.96 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.828 -179.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.772 ' HB ' HG22 ' A' ' 36' ' ' THR . 0.2 OUTLIER -125.68 129.29 72.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.424 0.63 . . . . 0.0 110.981 177.729 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.515 ' HB3' ' CG ' ' A' ' 35' ' ' ARG . 5.2 t0 -77.76 109.76 12.03 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.638 -1.165 . . . . 0.0 108.404 174.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -85.35 9.24 16.01 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.457 -174.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -94.76 -52.63 9.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.902 0.382 . . . . 0.0 110.082 174.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -103.55 -1.43 28.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.233 -178.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.8 mmtp 63.87 61.17 0.98 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.125 0.57 . . . . 0.0 111.981 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.515 ' CG ' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -123.97 135.93 53.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.896 176.886 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.772 HG22 ' HB ' ' A' ' 29' ' ' VAL . 0.5 OUTLIER -107.13 123.68 48.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.006 -179.322 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.406 HG23 ' CZ3' ' A' ' 16' ' ' TRP . 6.8 t -126.53 135.77 51.72 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.943 0.401 . . . . 0.0 110.512 173.122 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -88.55 -1.52 58.1 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.99 0.424 . . . . 0.0 110.512 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.42 165.64 16.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.142 178.326 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.3 t70 . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.741 -179.053 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.458 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 16.0 mt . . . . . 0 N--CA 1.448 -0.554 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.542 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 39.6 Cg_exo -59.62 163.37 13.26 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.332 2.021 . . . . 0.0 111.499 169.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -56.42 -38.64 71.84 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -173.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.7 -23.67 76.65 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 121.123 -0.561 . . . . 0.0 113.421 -178.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.542 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 87.3 m95 -85.66 129.33 34.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.328 0.585 . . . . 0.0 112.366 -174.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -110.23 139.8 45.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.329 171.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -95.22 107.83 19.94 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.567 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.5 mm-40 -113.47 167.79 10.29 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.932 -174.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.4 m -116.23 140.07 49.69 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 177.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -179.04 7.24 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.026 0.441 . . . . 0.0 110.727 -179.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.48 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -61.74 -32.83 73.1 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.718 -177.36 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -82.53 -43.8 16.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.781 -177.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 136.38 5.81 1.98 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 121.165 -0.541 . . . . 0.0 111.753 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.49 137.8 38.12 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 176.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 19' ' ' GLU . 1.5 p -88.92 152.2 3.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.419 0.628 . . . . 0.0 110.642 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.502 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 45.5 p90 -154.53 161.92 41.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.79 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -115.64 133.06 56.4 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.862 -176.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.605 ' HA ' ' O ' ' A' ' 35' ' ' ARG . 0.1 OUTLIER -131.42 119.92 44.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.316 0.579 . . . . 0.0 111.234 179.792 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.612 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 5.6 t0 -78.03 110.37 12.91 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 171.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -81.67 -8.12 59.67 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.035 -173.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.487 HG22 HD11 ' A' ' 32' ' ' ILE . 6.6 mm -77.96 -55.96 8.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.249 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -99.03 -0.03 42.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.357 -177.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? 68.6 60.46 0.37 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.861 173.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.612 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -122.71 119.79 31.73 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.286 177.902 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.553 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -107.75 112.79 25.64 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.055 177.389 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.4 t -126.24 130.89 51.81 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.064 0.459 . . . . 0.0 110.908 179.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -82.34 -10.4 59.1 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.591 179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.17 162.42 14.96 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.061 178.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.4 t0 . . . . . 0 C--N 1.324 -0.538 0 O-C-N 123.635 0.584 . . . . 0.0 110.94 -176.922 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.443 HD22 ' CD1' ' A' ' 28' ' ' PHE . 0.8 OUTLIER . . . . . 0 N--CA 1.451 -0.413 0 N-CA-C 110.415 -0.217 . . . . 0.0 110.415 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.567 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 51.3 Cg_exo -56.8 165.67 4.6 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.247 1.965 . . . . 0.0 111.278 170.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -61.58 -38.28 86.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.658 -171.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.63 -25.19 75.79 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.161 -0.542 . . . . 0.0 113.548 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.567 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 86.3 m95 -83.78 144.14 29.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.515 0.674 . . . . 0.0 112.676 -174.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.532 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 2.0 mt-10 -127.29 149.31 50.08 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.095 174.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.586 HE21 ' HE1' ' A' ' 28' ' ' PHE . 35.5 tt0 -96.88 102.89 14.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.697 177.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.492 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.6 mt-10 -105.48 178.86 4.44 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.989 0.423 . . . . 0.0 110.424 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.8 m -131.5 139.58 49.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.325 176.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.52 176.64 9.22 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.338 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.406 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 2.4 pt-20 -67.29 -26.34 66.49 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.771 -174.163 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -84.9 -35.11 22.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.963 0.411 . . . . 0.0 110.219 -179.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 126.15 15.09 2.87 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.216 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -83.52 142.52 30.84 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 174.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.476 HG22 ' O ' ' A' ' 19' ' ' GLU . 0.9 OUTLIER -90.97 154.94 3.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.303 0.573 . . . . 0.0 110.507 179.961 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.431 ' CB ' ' HA ' ' A' ' 38' ' ' TYR . 50.6 p90 -161.96 161.08 28.47 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.264 178.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.586 ' HE1' HE21 ' A' ' 18' ' ' GLN . 14.0 m-85 -116.88 139.96 50.01 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.045 -176.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.52 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.77 123.68 52.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.218 0.532 . . . . 0.0 111.515 -177.916 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -73.03 114.62 11.39 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 170.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.532 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 50.3 m-70 -84.98 -4.13 59.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.789 0.328 . . . . 0.0 111.375 -175.406 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.415 HG23 HD11 ' A' ' 32' ' ' ILE . 4.5 mm -95.97 -49.78 12.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.4 0.619 . . . . 0.0 109.952 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -98.43 -5.89 31.6 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.04 -177.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.16 56.32 1.77 Allowed 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 175.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.511 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -119.13 120.68 37.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.738 177.896 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.52 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -105.0 116.2 31.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.312 179.331 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.2 t -126.05 132.29 51.99 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.673 0.273 . . . . 0.0 110.429 177.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.431 ' HA ' ' CB ' ' A' ' 27' ' ' PHE . 8.2 m-85 -72.87 -25.52 61.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.019 0.438 . . . . 0.0 111.104 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.33 170.4 7.95 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.629 178.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 t0 . . . . . 0 C--N 1.323 -0.581 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.594 -175.272 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.577 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 15.9 mt . . . . . 0 N--CA 1.447 -0.606 0 CA-C-O 120.915 0.388 . . . . 0.0 111.463 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.452 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 46.4 Cg_exo -59.25 175.82 0.65 Allowed 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.382 2.722 . . . . 0.0 111.704 170.248 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -64.53 -40.1 94.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.258 -173.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . 0.414 ' CA ' HD13 ' A' ' 32' ' ' ILE . . . -68.1 -29.28 73.32 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.828 -0.701 . . . . 0.0 113.021 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.577 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 92.0 m95 -82.44 132.5 35.21 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -173.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.4 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -115.31 142.24 46.95 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.852 174.758 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.782 HE21 ' HE1' ' A' ' 28' ' ' PHE . 34.2 tt0 -91.22 102.77 15.49 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 176.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.653 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.6 mm-40 -110.57 168.82 9.18 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.296 0.57 . . . . 0.0 111.069 -175.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.1 m -122.99 135.15 54.36 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.661 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.473 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -83.07 -179.1 7.34 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.415 179.567 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -72.61 -15.98 61.73 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.515 -175.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.473 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 38.5 m-80 -88.31 -10.66 48.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.909 0.385 . . . . 0.0 110.314 177.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.17 17.22 57.94 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.787 -177.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -91.92 144.56 25.34 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.464 HG22 ' O ' ' A' ' 19' ' ' GLU . 0.5 OUTLIER -88.15 156.24 3.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.349 0.595 . . . . 0.0 110.81 -178.764 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.436 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.5 p90 -162.21 160.61 27.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.096 177.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.782 ' HE1' HE21 ' A' ' 18' ' ' GLN . 13.8 m-85 -116.82 135.28 53.86 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.219 -176.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.653 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -131.4 124.09 54.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 120.904 0.383 . . . . 0.0 110.825 179.704 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.536 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 1.4 t0 -76.78 131.64 38.82 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 170.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.4 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 70.8 m-70 -97.9 -0.75 44.37 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 121.003 -0.279 . . . . 0.0 111.651 -172.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.414 HD13 ' CA ' ' A' ' 15' ' ' GLY . 4.8 mt -92.58 -55.29 6.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.896 177.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -95.53 -14.96 23.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.748 0.308 . . . . 0.0 110.18 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.536 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 2.0 mmtt 70.58 71.76 0.2 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.98 176.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.571 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.6 mtp180 -122.38 119.12 30.1 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.24 174.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.612 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -104.01 114.09 28.09 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.469 178.833 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.31 138.59 53.08 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.666 0.269 . . . . 0.0 111.134 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -78.42 -14.65 59.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.848 0.356 . . . . 0.0 110.857 175.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -102.86 155.57 18.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.497 -178.386 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.2 t0 . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.199 -175.707 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.686 0 N-CA-C 111.991 -0.443 . . . . 0.0 111.991 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.39 -20.83 50.35 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.671 0.236 . . . . 0.0 110.86 -178.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.15 33.26 22.68 Favored 'General case' 0 C--O 1.233 0.192 0 O-C-N 123.669 0.606 . . . . 0.0 111.0 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.01 60.67 4.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.943 -176.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.509 ' HD2' ' HA ' ' A' ' 5' ' ' ARG . 4.5 tpt85 -142.46 -35.84 0.42 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.279 177.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.2 mtmm -140.05 127.82 21.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.268 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.29 53.02 2.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.014 0.435 . . . . 0.0 110.688 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.1 p -139.73 126.7 23.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.123 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -167.83 -36.4 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.842 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.57 45.11 2.19 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 111.358 -0.697 . . . . 0.0 111.358 -174.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -82.55 -68.58 0.69 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.002 0.43 . . . . 0.0 111.047 -176.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.447 HD22 ' CD1' ' A' ' 28' ' ' PHE . 34.6 mt -83.5 161.81 55.42 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.353 -177.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.484 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 23.6 Cg_exo -65.61 159.38 48.44 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.87 2.38 . . . . 0.0 111.396 173.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.5 137.23 36.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 121.125 0.488 . . . . 0.0 110.128 171.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.56 -43.06 1.76 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.484 -175.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.484 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 95.2 m95 -75.94 132.87 40.52 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.943 0.719 . . . . 0.0 112.943 -175.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -114.09 142.87 45.66 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.722 174.021 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -97.4 117.1 30.89 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.3 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.571 ' O ' HG22 ' A' ' 26' ' ' VAL . 4.3 mm-40 -127.41 174.54 8.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.087 0.47 . . . . 0.0 110.478 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -132.29 140.33 48.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.082 176.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.445 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -87.84 -173.81 4.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.074 0.464 . . . . 0.0 111.068 -178.501 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.448 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -73.56 -20.89 60.51 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.593 -176.885 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.445 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 44.0 m-80 -85.95 -6.4 59.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.098 0.475 . . . . 0.0 110.395 179.142 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.25 12.82 78.19 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.757 -178.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.49 124.59 32.98 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.072 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.571 HG22 ' O ' ' A' ' 19' ' ' GLU . 2.9 p -73.6 145.63 11.33 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 120.048 -0.661 . . . . 0.0 110.381 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -148.31 159.35 44.08 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.263 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.503 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 18.6 m-85 -120.51 137.77 54.19 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.091 -175.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.626 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.13 118.61 37.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-O 121.38 0.609 . . . . 0.0 110.701 -178.302 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.587 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -76.27 138.71 40.73 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.948 176.0 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -109.38 23.5 14.38 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.045 0.45 . . . . 0.0 111.176 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.431 HG23 HD11 ' A' ' 32' ' ' ILE . 5.8 mm -103.07 -53.8 7.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.483 175.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.9 -22.3 15.86 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.263 175.228 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 1.0 OUTLIER 77.11 62.64 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.907 172.925 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.486 ' HG3' ' OD2' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -122.49 123.58 41.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.929 0.395 . . . . 0.0 111.311 174.936 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.626 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -87.42 119.72 27.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.108 175.015 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 6.3 t -123.76 136.68 54.57 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.15 0.5 . . . . 0.0 110.422 178.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -89.77 11.9 18.7 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.823 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.0 156.92 32.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.445 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.521 ' OD1' ' HB2' ' A' ' 42' ' ' ARG . 8.3 t70 -74.1 118.01 66.07 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.925 -177.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.503 ' HD3' ' CD2' ' A' ' 28' ' ' PHE . 53.8 Cg_endo -94.18 43.75 0.22 Allowed 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 123.186 2.591 . . . . 0.0 112.666 -178.232 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.521 ' HB2' ' OD1' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -118.01 -4.45 11.05 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.073 176.67 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.7 -79.78 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 O-C-N 123.577 0.548 . . . . 0.0 112.061 -175.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -104.96 9.54 34.52 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.38 0.61 . . . . 0.0 110.712 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -102.16 64.92 0.95 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.814 -176.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.9 m -80.04 132.21 35.94 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.503 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.7 t -78.1 118.69 25.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.213 -178.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -97.78 96.92 8.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.462 177.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.607 ' HB3' ' HD3' ' A' ' 51' ' ' PRO . 2.5 t0 58.37 -162.7 0.22 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.282 -175.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.532 ' N ' ' HD3' ' A' ' 51' ' ' PRO . 1.9 p30 -147.31 55.38 2.34 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-O 120.613 0.244 . . . . 0.0 110.644 174.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.607 ' HD3' ' HB3' ' A' ' 49' ' ' ASP . 83.2 Cg_endo -96.42 -178.31 0.4 Allowed 'Trans proline' 0 N--CA 1.448 -1.171 0 C-N-CA 122.602 2.201 . . . . 0.0 112.132 -178.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.5 m -82.11 64.63 6.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.373 0.606 . . . . 0.0 109.766 173.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -94.77 121.28 63.26 Favored Pre-proline 0 N--CA 1.449 -0.5 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.911 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 1.3 Cg_endo . . . . . 0 C--O 1.246 0.906 0 C-N-CA 123.38 2.72 . . . . 0.0 111.251 175.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.915 0 N-CA-C 111.789 -0.524 . . . . 0.0 111.789 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -108.86 147.54 31.98 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 177.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.45 ' HB3' ' H ' ' A' ' 4' ' ' LYS . . . -95.18 -135.66 0.21 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.548 -0.297 . . . . 0.0 110.606 -179.084 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.45 ' H ' ' HB3' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -163.85 169.25 18.49 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -71.36 -79.51 0.07 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 173.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.08 40.81 18.23 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.318 173.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 7' ' ' ARG . 3.1 mtp180 -138.54 45.84 2.03 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.1 0.476 . . . . 0.0 109.884 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.1 t -103.64 -53.53 7.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.379 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -143.47 134.66 25.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.85 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -138.98 115.66 1.16 Allowed Glycine 0 N--CA 1.445 -0.715 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 176.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.81 -46.92 64.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.172 0.511 . . . . 0.0 110.869 -178.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.516 HD12 ' CD1' ' A' ' 28' ' ' PHE . 4.2 mt -79.3 171.95 11.15 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.89 178.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.562 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.5 Cg_exo -57.53 163.09 9.17 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.309 2.006 . . . . 0.0 111.546 170.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.81 -34.06 71.08 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.414 -172.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . 0.423 ' CA ' HD12 ' A' ' 32' ' ' ILE . . . -75.91 -23.74 71.28 Favored Glycine 0 CA--C 1.518 0.222 0 C-N-CA 121.083 -0.579 . . . . 0.0 113.278 -178.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.562 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 85.4 m95 -86.14 147.36 26.18 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.464 0.649 . . . . 0.0 112.654 -175.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.419 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 4.2 mm-40 -125.13 138.65 54.16 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.561 173.084 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -91.29 95.3 9.95 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.612 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.4 mm-40 -104.9 166.68 10.22 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.025 -175.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.0 m -124.72 137.65 54.33 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.565 176.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.91 -178.31 6.79 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.392 0.615 . . . . 0.0 110.814 -179.014 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -29.02 66.86 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.753 -176.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -75.02 -33.17 61.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.237 0.542 . . . . 0.0 109.738 178.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 113.6 21.25 5.83 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.934 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -96.5 131.95 42.57 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 174.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 19' ' ' GLU . 0.5 OUTLIER -78.63 151.13 5.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.504 0.668 . . . . 0.0 110.349 179.755 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -154.56 161.2 41.74 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.289 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.516 ' CD1' HD12 ' A' ' 12' ' ' LEU . 14.1 m-85 -116.58 131.69 56.88 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.281 -176.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.893 ' HB ' HG21 ' A' ' 36' ' ' THR . 0.2 OUTLIER -128.94 123.8 59.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.278 0.561 . . . . 0.0 110.917 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -72.91 119.71 17.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 171.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.419 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 38.3 m-70 -89.51 0.73 56.68 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.276 0.56 . . . . 0.0 111.295 -174.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.423 HD12 ' CA ' ' A' ' 15' ' ' GLY . 12.3 mt -105.34 -52.53 7.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.871 174.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.476 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 71.0 m-80 -89.09 6.29 40.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.937 -178.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.476 ' HG2' ' O ' ' A' ' 33' ' ' ASN . 0.0 OUTLIER 42.27 53.9 4.35 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.607 1.163 . . . . 0.0 113.61 177.695 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.543 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 8.7 mtp180 -116.01 124.07 49.57 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 122.182 -0.324 . . . . 0.0 110.322 176.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.893 HG21 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.96 112.82 26.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.405 177.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.4 t -126.21 139.71 53.13 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 120.877 0.37 . . . . 0.0 110.827 -179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -91.2 5.42 49.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.87 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.08 165.87 14.71 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.883 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -74.26 111.79 14.24 Favored Pre-proline 0 C--N 1.327 -0.399 0 O-C-N 123.4 0.438 . . . . 0.0 110.491 -178.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.513 ' O ' ' HB2' ' A' ' 45' ' ' PHE . 72.6 Cg_endo -80.76 7.87 4.61 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.867 2.378 . . . . 0.0 112.607 -176.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.5 mtp180 -103.68 -3.83 24.56 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.67 0.272 . . . . 0.0 110.774 176.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 28.5 mt -74.12 -81.34 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.623 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -93.23 7.54 43.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.218 0.532 . . . . 0.0 111.584 -175.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.513 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 7.0 m-85 -117.62 55.05 0.87 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.043 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -65.43 0.68 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.616 -177.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -70.56 -67.12 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.473 179.19 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -167.99 156.25 8.89 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 177.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -80.21 84.1 5.95 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 176.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.629 ' N ' ' HD3' ' A' ' 51' ' ' PRO . 7.5 t-20 -143.0 49.99 1.33 Allowed Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.339 -178.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.629 ' HD3' ' N ' ' A' ' 50' ' ' ASN . 1.5 Cg_endo -84.82 -30.94 0.47 Allowed 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.298 1.999 . . . . 0.0 111.93 175.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -143.24 -91.61 0.12 Allowed 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.205 0.526 . . . . 0.0 110.777 -177.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.92 120.62 3.63 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.507 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo . . . . . 0 C--O 1.252 1.183 0 C-N-CA 122.806 2.337 . . . . 0.0 112.147 -178.09 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.981 0 N-CA-C 111.786 -0.526 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.62 83.65 1.14 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.245 0.545 . . . . 0.0 111.174 -179.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -127.97 169.79 13.6 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.323 178.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.98 148.08 36.22 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.555 ' HE ' ' HA ' ' A' ' 49' ' ' ASP . 2.0 ttp85 -71.44 146.22 48.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.985 0.421 . . . . 0.0 111.319 -177.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.76 170.75 16.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.167 177.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.455 ' HD3' ' HA ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -77.76 95.19 4.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.976 0.417 . . . . 0.0 110.157 178.226 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.405 ' H ' HG21 ' A' ' 8' ' ' VAL . 0.0 OUTLIER -77.28 165.56 3.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.859 178.852 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -152.33 -164.48 1.97 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.388 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -68.5 -66.88 2.13 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 121.144 -0.551 . . . . 0.0 112.913 -177.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.55 -84.39 0.1 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -179.158 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.639 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 0.1 OUTLIER -103.2 154.9 37.33 Favored Pre-proline 0 CA--C 1.515 -0.381 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 170.391 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.576 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 32.4 Cg_exo -57.24 167.46 3.44 Favored 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.315 2.01 . . . . 0.0 111.187 169.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.408 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 0.3 OUTLIER -55.94 -37.48 69.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.057 -174.09 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -78.42 -23.73 64.69 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.647 -0.787 . . . . 0.0 113.113 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.639 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 92.6 m95 -87.9 144.58 26.49 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -173.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.438 ' HB2' ' HD2' ' A' ' 31' ' ' HIS . 1.8 mm-40 -130.26 146.48 51.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.664 176.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.2 tt0 -97.43 104.38 16.39 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.985 0.422 . . . . 0.0 110.432 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.62 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.2 mt-10 -114.18 165.23 12.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.017 -178.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.43 145.37 44.18 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.933 0.397 . . . . 0.0 110.567 177.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.04 -177.93 6.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.975 0.416 . . . . 0.0 110.353 179.158 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.435 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -65.68 -28.16 68.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.668 -175.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -85.18 -46.12 11.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.159 0.504 . . . . 0.0 110.737 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.69 12.15 0.8 Allowed Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.899 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.48 133.67 34.46 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 175.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.5 p -86.16 153.93 3.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.428 0.632 . . . . 0.0 110.983 -178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.62 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 54.4 p90 -155.29 163.0 40.73 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.834 -1.075 . . . . 0.0 109.263 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.66 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 11.4 m-85 -118.92 137.87 53.17 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.826 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.761 ' HB ' HG21 ' A' ' 36' ' ' THR . 0.1 OUTLIER -130.75 125.06 57.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 121.162 0.505 . . . . 0.0 111.269 -178.047 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -76.68 99.26 5.0 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 173.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.438 ' HD2' ' HB2' ' A' ' 17' ' ' GLU . 30.8 m-70 -75.82 -7.43 54.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.698 0.285 . . . . 0.0 111.193 -172.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 46.6 mm -63.29 -48.94 85.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.124 0.488 . . . . 0.0 110.317 176.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.69 2.47 14.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.598 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.49 ' N ' ' HE3' ' A' ' 34' ' ' LYS . 0.0 OUTLIER 60.61 62.99 1.4 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.588 176.307 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -122.84 125.34 45.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.753 0.311 . . . . 0.0 110.376 173.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.761 HG21 ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -97.7 120.56 38.3 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.944 -178.707 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.8 t -126.37 139.28 53.4 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.152 0.501 . . . . 0.0 110.441 176.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -85.63 -12.05 52.37 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.368 0.604 . . . . 0.0 110.027 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.53 149.67 26.46 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.348 179.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.481 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 0.8 OUTLIER -78.77 119.52 77.56 Favored Pre-proline 0 N--CA 1.437 -1.089 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.166 -176.011 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.66 ' HD3' ' CD2' ' A' ' 28' ' ' PHE . 1.5 Cg_endo -86.39 39.36 0.64 Allowed 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 123.231 2.621 . . . . 0.0 112.152 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.421 HH11 ' HB2' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -112.14 36.27 3.42 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.27 0.557 . . . . 0.0 109.835 -179.703 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mt -112.57 -81.65 0.59 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.18 -177.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.68 3.25 41.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.253 0.549 . . . . 0.0 111.441 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -90.25 78.21 6.57 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.924 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -138.65 -170.25 2.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.635 -178.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 6.8 t -84.54 63.53 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.466 0.65 . . . . 0.0 111.053 -178.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -110.59 126.8 54.83 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 170.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.555 ' HA ' ' HE ' ' A' ' 5' ' ' ARG . 3.4 t0 -59.2 -81.19 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -171.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.8 t30 40.76 67.38 2.91 Favored Pre-proline 0 N--CA 1.47 0.567 0 O-C-N 124.084 0.865 . . . . 0.0 111.531 -174.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -80.39 51.3 3.86 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.737 2.291 . . . . 0.0 112.761 -175.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.29 163.13 27.32 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.901 0.381 . . . . 0.0 110.665 178.141 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.4 mmtt -66.56 151.05 96.85 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.862 176.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo . . . . . 0 C--O 1.247 0.956 0 C-N-CA 122.961 2.441 . . . . 0.0 112.477 -178.696 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.721 0 N-CA-C 111.836 -0.506 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.24 82.2 3.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.039 0.447 . . . . 0.0 110.614 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -140.58 114.19 8.79 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.466 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.508 ' HB2' ' HE2' ' A' ' 6' ' ' LYS . 3.1 pttt -60.98 -38.35 85.67 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.875 -179.486 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 54.06 43.93 30.02 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.728 176.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.508 ' HE2' ' HB2' ' A' ' 4' ' ' LYS . 8.4 mmtt -80.89 77.43 7.77 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' A' ' 6' ' ' LYS . 17.1 mmt180 74.19 -48.76 0.66 Allowed 'General case' 0 N--CA 1.469 0.522 0 O-C-N 124.023 0.827 . . . . 0.0 110.689 -176.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 21.7 t -75.52 120.76 25.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.742 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -141.54 -24.84 0.71 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.431 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.04 41.47 60.78 Favored Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 -178.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -108.61 -45.35 3.87 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.86 0.362 . . . . 0.0 111.684 -174.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.512 HD22 ' CD1' ' A' ' 28' ' ' PHE . 7.0 mt -95.95 161.02 28.75 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.372 -171.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.46 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.0 Cg_exo -58.82 174.67 0.77 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.455 2.77 . . . . 0.0 112.319 170.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -64.77 -41.09 96.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.403 -175.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.34 -25.25 75.64 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.882 -0.675 . . . . 0.0 113.256 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.46 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 92.1 m95 -87.57 142.94 27.46 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.412 0.625 . . . . 0.0 112.601 -175.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.37 154.06 34.19 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.063 174.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -105.23 101.88 11.4 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.619 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.3 mm-40 -113.17 165.52 12.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.678 -175.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.7 m -116.45 138.25 51.52 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.794 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.78 178.6 7.24 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 121.343 0.592 . . . . 0.0 110.506 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.417 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.5 OUTLIER -59.68 -39.58 84.98 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.125 -177.239 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -73.08 -49.59 27.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.778 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 139.42 10.88 0.79 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.974 -0.631 . . . . 0.0 112.033 -178.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -85.66 143.17 28.56 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 19' ' ' GLU . 1.4 p -86.35 156.7 3.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.233 0.539 . . . . 0.0 111.052 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.485 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 45.9 p90 -158.85 161.91 36.91 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.608 178.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.512 ' CD1' HD22 ' A' ' 12' ' ' LEU . 12.9 m-85 -116.97 132.52 56.68 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.442 -176.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.619 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -130.02 130.0 65.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.836 179.017 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.49 132.4 36.32 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 172.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.0 m-70 -100.77 15.76 27.27 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.251 -0.58 . . . . 0.0 111.666 -173.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.2 mt -99.01 -54.27 7.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.078 173.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 34' ' ' LYS . 2.7 m-80 -95.15 -15.97 22.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.249 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 33' ' ' ASN . 0.4 OUTLIER 74.31 39.49 0.47 Allowed 'General case' 0 N--CA 1.464 0.271 0 O-C-N 124.191 0.932 . . . . 0.0 111.529 177.796 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 58.5 mtp180 -89.8 136.01 33.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.86 0.362 . . . . 0.0 110.538 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.468 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.4 OUTLIER -115.89 118.06 31.93 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.377 -178.74 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.3 t -125.46 131.94 52.78 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.004 0.431 . . . . 0.0 110.263 176.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -88.91 0.08 56.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.46 0.647 . . . . 0.0 109.926 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.92 163.45 15.54 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.031 176.465 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.541 ' HB3' ' CD1' ' A' ' 43' ' ' LEU . 32.3 t0 -66.78 121.23 76.69 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.715 -178.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.628 ' O ' ' HB2' ' A' ' 45' ' ' PHE . 9.5 Cg_exo -70.61 -17.97 33.35 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.343 2.695 . . . . 0.0 113.582 -175.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.538 ' HG2' ' OD1' ' A' ' 40' ' ' ASP . 6.1 ptp85 -88.75 5.95 41.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.993 0.425 . . . . 0.0 110.885 -177.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.541 ' CD1' ' HB3' ' A' ' 40' ' ' ASP . 86.3 mt -88.54 -93.84 0.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.457 178.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.66 3.6 40.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.907 -172.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.628 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 44.9 m-85 -105.86 5.96 31.14 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.103 0.478 . . . . 0.0 110.065 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.77 99.54 3.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.149 179.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 77.0 152.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.37 0 C-N-CA 123.505 0.722 . . . . 0.0 112.149 175.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 17.9 t70 70.99 85.85 0.13 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.086 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.25 134.28 44.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.549 -178.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.468 ' H ' ' HD2' ' A' ' 51' ' ' PRO . 50.3 t30 -167.8 -52.16 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.41 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.468 ' HD2' ' H ' ' A' ' 50' ' ' ASN . 61.3 Cg_endo -73.75 53.67 2.83 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 121.929 1.752 . . . . 0.0 112.461 178.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.25 35.62 2.05 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.747 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 0.8 OUTLIER -160.18 100.88 1.41 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.695 179.033 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 5.5 Cg_exo . . . . . 0 C--O 1.248 1.008 0 C-N-CA 123.279 2.652 . . . . 0.0 112.278 -176.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.802 0 N-CA-C 112.249 -0.34 . . . . 0.0 112.249 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.4 -82.15 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.114 0.566 . . . . 0.0 111.68 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.4 122.71 48.48 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.977 0.417 . . . . 0.0 110.904 -177.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.08 101.16 6.16 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.872 176.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.456 ' H ' ' HG3' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -71.85 154.47 41.24 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.135 179.441 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 62.89 54.14 2.28 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.231 0.539 . . . . 0.0 110.026 -176.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.1 ptt-85 -107.78 23.78 13.95 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.772 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -86.41 54.53 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.047 -178.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -104.05 119.22 38.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.22 -178.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.15 65.65 4.09 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.969 -0.634 . . . . 0.0 111.985 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -101.9 -51.63 3.37 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.391 0.615 . . . . 0.0 110.513 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.511 HD21 ' CD1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -103.58 170.79 5.77 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.318 -176.802 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.522 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 72.4 Cg_exo -52.53 168.62 0.42 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.137 2.558 . . . . 0.0 112.033 168.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -64.89 -38.36 90.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.165 -173.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.73 -27.04 71.48 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.056 -0.593 . . . . 0.0 113.05 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.522 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 94.2 m95 -85.21 141.94 29.79 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -176.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -124.29 138.75 54.36 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.92 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.653 HE21 ' HE1' ' A' ' 28' ' ' PHE . 8.7 tt0 -88.08 100.6 13.06 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.265 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.574 ' O ' HG23 ' A' ' 26' ' ' VAL . 3.3 mm-40 -100.96 172.23 7.15 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.506 -178.171 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 m -134.25 134.69 42.27 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.33 174.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.6 -174.28 5.19 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.527 -175.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.468 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -70.58 -31.58 68.64 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.311 -177.44 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -76.17 -25.65 55.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.36 0.6 . . . . 0.0 109.903 178.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 105.95 12.07 26.75 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.769 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.97 144.19 30.16 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 174.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 19' ' ' GLU . 1.1 p -86.94 153.87 3.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-O 121.145 0.498 . . . . 0.0 110.25 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -159.41 156.69 28.87 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.171 178.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.653 ' HE1' HE21 ' A' ' 18' ' ' GLN . 11.3 m-85 -113.18 132.72 55.37 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.012 -175.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.801 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -125.41 123.54 65.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-O 121.474 0.654 . . . . 0.0 111.169 -179.145 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.588 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 12.1 t0 -77.38 133.57 38.66 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.528 172.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.4 m-70 -100.84 -2.84 31.11 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 120.711 0.291 . . . . 0.0 111.271 -174.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.2 mt -88.09 -61.72 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 120.899 0.381 . . . . 0.0 110.304 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.521 ' C ' ' HG2' ' A' ' 34' ' ' LYS . 3.1 p30 -106.91 23.25 14.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.102 0.477 . . . . 0.0 110.615 178.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.588 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.0 OUTLIER 38.1 75.38 0.07 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.799 1.24 . . . . 0.0 113.894 173.499 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.462 ' HD3' ' CH2' ' A' ' 16' ' ' TRP . 0.0 OUTLIER -122.23 119.41 31.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.715 0.293 . . . . 0.0 110.401 172.944 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.801 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -99.83 113.99 26.87 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.195 178.01 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.7 t -126.33 132.87 51.52 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.391 0.139 . . . . 0.0 110.735 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -76.6 -26.89 55.48 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.212 0.53 . . . . 0.0 110.306 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.26 168.82 8.93 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.357 -178.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.503 ' OD2' ' HG ' ' A' ' 43' ' ' LEU . 13.5 t70 -63.54 125.92 88.45 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.052 -176.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -88.79 35.71 0.39 Allowed 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 123.367 2.712 . . . . 0.0 112.623 -178.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -127.82 -31.58 2.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.848 179.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.503 ' HG ' ' OD2' ' A' ' 40' ' ' ASP . 11.6 mt -50.96 -71.63 0.06 Allowed 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.728 0.643 . . . . 0.0 111.966 -176.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -104.93 8.38 34.56 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.064 0.459 . . . . 0.0 110.865 -178.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -102.52 24.31 10.6 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.62 -177.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.79 -102.44 0.37 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.19 178.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.11 -44.34 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.058 176.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.1 30.55 20.0 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.373 177.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -156.75 34.64 0.3 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.666 177.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.545 ' HB3' ' HD3' ' A' ' 51' ' ' PRO . 4.6 t-20 -123.66 -50.79 0.04 OUTLIER Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.692 -177.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.545 ' HD3' ' HB3' ' A' ' 50' ' ' ASN . 24.9 Cg_exo -63.77 -90.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.017 1.812 . . . . 0.0 112.109 177.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.457 ' H ' ' HB2' ' A' ' 51' ' ' PRO . 1.8 m -140.77 99.48 3.62 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.03 0.443 . . . . 0.0 110.676 177.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.8 -47.18 1.79 Allowed Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.263 176.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo . . . . . 0 C--N 1.358 1.065 0 C-N-CA 121.949 1.766 . . . . 0.0 111.924 175.584 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 N-CA-C 111.776 -0.529 . . . . 0.0 111.776 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.16 2.91 56.31 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -177.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -88.58 26.78 1.4 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.805 0.336 . . . . 0.0 111.636 -175.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.89 6.37 39.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.622 178.089 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.9 mtt85 72.45 167.68 0.31 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.094 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -89.72 50.11 1.84 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.075 0.464 . . . . 0.0 110.592 -177.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -85.24 61.67 7.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.204 -177.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.449 HG23 ' HB2' ' A' ' 42' ' ' ARG . 2.4 p -124.2 94.2 2.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.876 0.846 . . . . 0.0 110.587 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -99.86 62.59 1.16 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.95 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.68 -54.78 4.96 Favored Glycine 0 N--CA 1.451 -0.33 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.684 -175.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.576 ' HA ' HH21 ' A' ' 42' ' ' ARG . 2.6 t70 -92.47 -167.2 1.7 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 176.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.427 HD22 ' CD1' ' A' ' 28' ' ' PHE . 0.5 OUTLIER -78.78 168.97 22.87 Favored Pre-proline 0 C--N 1.317 -0.819 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.988 175.884 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.584 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 42.9 Cg_exo -56.53 158.11 16.9 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 121.874 1.716 . . . . 0.0 110.911 169.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -36.73 70.01 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.101 -0.499 . . . . 0.0 112.072 -171.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.32 -30.37 75.3 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.877 -0.677 . . . . 0.0 113.249 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.584 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 86.6 m95 -81.39 130.38 35.02 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -173.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.409 ' HA ' ' OE1' ' A' ' 17' ' ' GLU . 4.9 mm-40 -114.25 150.98 33.55 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.015 174.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -96.7 104.62 16.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.821 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.592 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 0.8 OUTLIER -115.63 166.2 12.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.137 0.494 . . . . 0.0 110.64 -176.94 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.03 139.89 53.4 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.587 174.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.415 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -81.3 -179.07 7.2 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.382 0.61 . . . . 0.0 110.713 -179.273 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.33 -11.51 60.73 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.013 -173.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.415 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 29.5 m-80 -101.81 -6.32 23.75 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.056 0.455 . . . . 0.0 110.252 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 91.12 16.11 54.56 Favored Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.969 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -89.46 125.45 35.18 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 175.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.477 HG22 ' O ' ' A' ' 19' ' ' GLU . 6.0 p -75.89 150.96 6.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.471 0.653 . . . . 0.0 110.992 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.432 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 41.1 p90 -156.17 158.53 37.79 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.541 -1.208 . . . . 0.0 108.76 176.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.427 ' CD1' HD22 ' A' ' 12' ' ' LEU . 30.3 m-85 -119.01 136.59 54.04 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.507 -176.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.981 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -133.27 124.28 48.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.482 0.658 . . . . 0.0 111.979 -176.509 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.443 ' HB2' ' CE2' ' A' ' 16' ' ' TRP . 50.4 t0 -74.05 109.58 7.66 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.308 171.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 43.2 m-70 -82.52 -1.54 50.81 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.07 0.462 . . . . 0.0 111.101 -175.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.8 mm -97.03 -52.94 8.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.835 176.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -90.7 -5.42 55.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.159 -178.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 62.15 61.29 1.35 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.455 176.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.631 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -123.8 118.94 28.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.688 177.102 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.981 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.01 109.41 21.4 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.483 176.433 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.8 t -123.85 136.76 54.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.189 0.519 . . . . 0.0 110.72 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -83.71 5.2 25.52 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.257 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.32 152.89 28.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.77 0.319 . . . . 0.0 110.639 179.05 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.589 ' OD1' ' HG2' ' A' ' 42' ' ' ARG . 17.4 t0 -78.01 114.68 44.1 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.343 -174.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.469 ' HA ' ' CE1' ' A' ' 45' ' ' PHE . 5.6 Cg_exo -80.76 20.37 0.99 Allowed 'Trans proline' 0 CA--C 1.534 0.488 0 C-N-CA 123.667 2.912 . . . . 0.0 113.437 -179.09 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.589 ' HG2' ' OD1' ' A' ' 40' ' ' ASP . 3.1 ptp85 -108.57 -1.07 19.94 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.201 176.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mt -87.92 -79.95 0.28 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.857 0.361 . . . . 0.0 111.81 -176.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.78 11.36 6.04 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -172.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.469 ' CE1' ' HA ' ' A' ' 41' ' ' PRO . 5.6 m-85 -96.82 -15.14 21.44 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.409 0.623 . . . . 0.0 110.346 -179.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.433 HG21 HG12 ' A' ' 8' ' ' VAL . 0.2 OUTLIER -81.33 75.81 8.28 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.765 178.006 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -76.47 59.16 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.091 0.472 . . . . 0.0 110.277 176.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -84.32 -44.74 13.51 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.198 -178.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -90.61 162.24 15.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.892 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.447 HD22 HG23 ' A' ' 52' ' ' THR . 12.9 t30 -83.59 120.17 74.94 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.439 -178.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -81.0 66.99 8.79 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.873 2.382 . . . . 0.0 112.488 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.447 HG23 HD22 ' A' ' 50' ' ' ASN . 0.0 OUTLIER -58.93 -70.63 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.803 177.563 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -171.03 130.29 0.78 Allowed Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.442 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo . . . . . 0 C--O 1.25 1.102 0 C-N-CA 122.657 2.238 . . . . 0.0 111.97 -179.458 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.636 0 N-CA-C 112.167 -0.373 . . . . 0.0 112.167 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.34 -38.01 5.84 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.909 0.385 . . . . 0.0 110.397 178.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.72 164.98 25.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.608 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.87 67.35 5.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.171 0.51 . . . . 0.0 110.813 -177.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.47 -24.91 17.11 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.313 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.9 mtpp 60.31 -107.08 0.29 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.293 178.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -165.58 -58.56 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.317 0.58 . . . . 0.0 109.525 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.0 t -131.14 117.98 39.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.225 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -122.7 10.9 9.71 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.27 0.557 . . . . 0.0 109.938 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.06 -123.35 6.31 Favored Glycine 0 N--CA 1.443 -0.884 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.563 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.61 -88.89 0.35 Allowed 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 175.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.453 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 49.3 mt -89.77 161.49 38.64 Favored Pre-proline 0 N--CA 1.446 -0.643 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 168.104 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.578 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 49.9 Cg_exo -56.29 163.53 6.32 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 121.759 1.639 . . . . 0.0 110.925 174.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -55.6 -38.3 69.25 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.949 -170.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -76.29 -25.32 66.28 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.147 -0.549 . . . . 0.0 114.323 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.578 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 88.5 m95 -83.99 143.55 29.72 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -172.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.415 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -121.15 149.54 42.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.634 173.595 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -98.82 103.09 15.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.107 0.479 . . . . 0.0 109.769 179.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.429 ' O ' HG21 ' A' ' 26' ' ' VAL . 7.3 mm-40 -105.31 167.22 9.88 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.143 -177.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.9 m -134.57 138.8 44.89 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.077 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.432 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -78.18 172.29 13.78 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 121.349 0.595 . . . . 0.0 109.47 178.185 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -72.47 -10.37 59.7 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.771 -172.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.432 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 35.5 m-80 -100.05 -1.59 36.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.265 0.555 . . . . 0.0 110.004 178.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 90.55 15.45 56.85 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.564 -0.744 . . . . 0.0 113.252 176.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -88.2 120.9 30.0 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 173.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.429 HG21 ' O ' ' A' ' 19' ' ' GLU . 0.8 OUTLIER -74.68 154.01 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.389 0.614 . . . . 0.0 110.829 -178.847 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -160.75 155.26 23.51 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.293 176.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.414 ' CD1' HD12 ' A' ' 12' ' ' LEU . 19.8 m-85 -113.12 136.98 52.12 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.951 -175.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.857 ' HB ' HG22 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.74 122.35 49.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.242 0.544 . . . . 0.0 111.087 -177.816 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.477 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -76.0 128.16 34.47 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 172.942 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.415 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 67.4 m-70 -99.05 15.07 27.03 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.806 0.336 . . . . 0.0 111.317 -175.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 21.9 mm -91.49 -55.52 6.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.085 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -120.64 3.01 10.69 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.5 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.0 OUTLIER 73.61 79.42 0.13 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.454 -0.793 . . . . 0.0 112.611 170.199 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.662 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -122.77 118.27 27.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.293 173.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.857 HG22 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.78 114.71 29.02 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.172 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.2 t -126.25 134.13 51.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.658 0.266 . . . . 0.0 110.772 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -79.26 -17.83 53.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.142 0.496 . . . . 0.0 110.971 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.741 HD22 HD13 ' A' ' 43' ' ' LEU . 0.5 OUTLIER -106.4 159.34 16.22 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.589 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.447 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 2.3 t70 -69.95 128.26 91.86 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.753 -176.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 40' ' ' ASP . 2.7 Cg_exo -76.17 14.05 1.19 Allowed 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.289 2.66 . . . . 0.0 113.574 -175.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.28 -6.1 11.3 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 122.316 -0.24 . . . . 0.0 110.78 178.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.741 HD13 HD22 ' A' ' 39' ' ' LEU . 71.0 mt -83.92 -88.61 0.1 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.827 0.346 . . . . 0.0 111.295 -178.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -94.5 10.93 32.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.93 -176.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.474 ' HE1' HD21 ' A' ' 39' ' ' LEU . 50.4 m-85 -97.18 89.01 4.63 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.464 178.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -56.7 13.89 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.552 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 85.3 t -141.55 94.74 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.052 177.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -84.48 69.38 10.55 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.717 0.77 . . . . 0.0 109.643 176.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -159.26 -42.29 0.06 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.23 -177.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -113.01 143.85 29.95 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.767 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.35 -42.96 63.04 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.756 2.304 . . . . 0.0 112.705 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 58.5 44.1 18.42 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.803 0.811 . . . . 0.0 109.772 -175.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.799 ' HG2' ' HD2' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -149.06 150.37 32.02 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.153 -0.931 . . . . 0.0 109.786 -174.471 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.799 ' HD2' ' HG2' ' A' ' 53' ' ' LYS . 32.8 Cg_endo . . . . . 0 C--O 1.246 0.891 0 C-N-CA 122.227 1.951 . . . . 0.0 111.622 172.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.693 0 N-CA-C 111.862 -0.495 . . . . 0.0 111.862 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.71 142.67 51.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.852 0.358 . . . . 0.0 111.264 -178.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.04 71.62 0.76 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.85 176.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -82.51 55.97 3.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.62 -175.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -109.68 -175.11 2.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.834 -179.48 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.5 tptt -72.88 85.97 1.27 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.14 0.495 . . . . 0.0 109.702 175.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.522 ' HA ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -85.68 62.77 7.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.687 -175.482 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 1.057 ' HA ' ' HA ' ' A' ' 13' ' ' PRO . 3.4 m -101.45 150.22 6.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.67 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -106.53 10.64 31.2 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.324 0.583 . . . . 0.0 110.241 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 124.2 -91.46 0.43 Allowed Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.156 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -60.84 -78.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 175.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.515 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 84.2 mt -99.03 173.65 3.67 Favored Pre-proline 0 N--CA 1.449 -0.508 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.394 174.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 1.057 ' HA ' ' HA ' ' A' ' 8' ' ' VAL . 36.5 Cg_exo -63.63 177.4 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.393 2.062 . . . . 0.0 112.465 173.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.415 ' HB3' ' HG3' ' A' ' 7' ' ' ARG . 1.0 OUTLIER -58.39 -39.05 78.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.766 -171.769 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -90.99 -15.64 55.81 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.56 -0.829 . . . . 0.0 113.909 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.568 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 85.3 m95 -89.22 139.47 30.45 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -171.045 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -120.36 132.13 55.14 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.853 174.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -80.84 104.48 11.38 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 176.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.55 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.0 OUTLIER -114.93 164.5 14.05 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.371 -178.422 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 18.2 m -129.27 138.81 51.85 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.4 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.18 178.71 3.7 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.504 0.668 . . . . 0.0 110.946 -177.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.468 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -68.15 -19.94 64.85 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.864 -173.307 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -93.06 -43.81 8.7 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.443 -178.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 139.05 18.5 0.51 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.665 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.494 ' HB3' ' HE2' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -90.63 126.96 36.13 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 175.462 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -79.79 153.83 4.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 120.283 -0.567 . . . . 0.0 110.743 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.7 p90 -162.97 158.72 22.63 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.843 178.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -116.94 138.08 51.79 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.514 -177.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 1.013 ' HB ' HG22 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.8 124.35 53.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.364 0.602 . . . . 0.0 111.411 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -74.31 107.76 6.67 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 170.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -82.52 1.19 39.03 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.159 0.504 . . . . 0.0 111.117 -174.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.3 mm -97.73 -55.38 6.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.351 0.596 . . . . 0.0 109.623 176.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -92.56 -1.12 57.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.379 -176.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm 59.6 61.51 1.96 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.692 175.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.586 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -124.07 117.78 25.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.611 175.647 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 1.013 HG22 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -103.72 114.11 28.12 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.289 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.3 t -125.54 132.42 52.59 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.976 0.417 . . . . 0.0 110.746 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.494 ' HE2' ' HB3' ' A' ' 25' ' ' GLN . 26.0 m-85 -83.75 -4.91 59.01 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.764 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.501 HD12 ' H ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -115.54 172.08 7.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.436 175.942 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.501 ' H ' HD12 ' A' ' 39' ' ' LEU . 10.1 t70 -78.75 121.23 83.26 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.282 -174.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.441 ' O ' ' HB2' ' A' ' 45' ' ' PHE . 63.1 Cg_endo -94.81 7.24 2.2 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.155 2.57 . . . . 0.0 112.983 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -92.31 -14.49 28.72 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.311 -176.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.3 mt -70.24 -91.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.493 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -105.9 2.82 27.9 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -174.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.441 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 96.4 m-85 -91.97 15.79 12.47 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.326 -174.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.31 -11.31 14.88 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.844 0.354 . . . . 0.0 111.49 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.482 ' HB ' ' H ' ' A' ' 48' ' ' ASP . 0.0 OUTLIER -135.85 -146.3 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.165 -175.652 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.482 ' H ' ' HB ' ' A' ' 47' ' ' VAL . 1.2 t0 -86.96 -164.23 1.04 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.817 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -75.55 119.59 19.81 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.399 178.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.494 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 0.1 OUTLIER -77.15 126.35 85.41 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 179.093 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 50' ' ' ASN . 31.1 Cg_endo -96.7 90.31 0.08 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.114 0 C-N-CA 123.426 2.751 . . . . 0.0 113.332 -178.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.5 15.38 11.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.751 0.786 . . . . 0.0 109.618 171.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.8 mtpt -105.69 149.21 37.65 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.334 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo . . . . . 0 C--O 1.249 1.066 0 C-N-CA 122.729 2.286 . . . . 0.0 112.169 177.769 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.825 0 N-CA-C 111.774 -0.53 . . . . 0.0 111.774 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.71 73.17 7.68 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.885 0.343 . . . . 0.0 110.846 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -77.07 -35.18 56.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.141 0.496 . . . . 0.0 110.512 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.39 72.21 10.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.197 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.2 ttm105 -81.82 133.33 35.32 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.515 -177.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.61 -178.97 6.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.779 173.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.43 88.67 0.9 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.492 0.663 . . . . 0.0 111.028 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.0 m -109.99 -11.96 11.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.651 176.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 66.66 -73.79 0.07 Allowed 'General case' 0 N--CA 1.467 0.41 0 O-C-N 123.939 0.775 . . . . 0.0 111.262 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -155.22 172.63 33.48 Favored Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 111.729 -0.549 . . . . 0.0 111.729 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -85.85 -4.48 59.18 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.286 0.565 . . . . 0.0 110.652 -179.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.507 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 43.9 mt -87.96 169.41 14.0 Favored Pre-proline 0 C--N 1.32 -0.714 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.436 -178.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.513 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 50.7 Cg_exo -59.39 173.9 1.27 Allowed 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 123.366 2.711 . . . . 0.0 112.348 170.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.4 -41.72 94.46 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.034 -175.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -74.48 -28.89 62.68 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.613 -177.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.513 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 91.6 m95 -83.84 134.53 34.7 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.252 0.549 . . . . 0.0 112.394 -173.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -119.35 143.09 47.59 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.563 174.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -94.34 106.76 18.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.922 0.391 . . . . 0.0 109.997 -177.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.556 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.5 mt-10 -114.85 167.8 10.46 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.373 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.2 m -124.29 136.63 54.27 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.173 175.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.1 177.32 9.03 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.099 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -64.92 -35.01 79.77 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.245 -176.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -67.05 -37.72 84.54 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.301 0.572 . . . . 0.0 109.82 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 116.6 15.96 6.68 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.343 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -87.69 137.69 32.12 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 173.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.491 HG21 ' O ' ' A' ' 19' ' ' GLU . 2.9 p -84.26 145.5 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 120.015 -0.674 . . . . 0.0 109.938 178.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.514 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.2 p90 -147.18 155.49 42.16 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.502 -179.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.506 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 17.9 m-85 -114.35 132.17 56.29 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.872 -174.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 1.063 ' HB ' HG21 ' A' ' 36' ' ' THR . 0.1 OUTLIER -131.07 120.3 46.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-O 121.142 0.496 . . . . 0.0 110.85 -179.122 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.478 ' HB3' ' HD3' ' A' ' 35' ' ' ARG . 4.6 t0 -78.7 112.68 16.06 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 171.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.6 m-70 -82.82 -10.15 58.99 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.043 -172.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.0 mm -75.32 -56.54 8.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.915 ' HB2' ' HD2' ' A' ' 35' ' ' ARG . 61.9 m-80 -93.57 -5.08 49.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.599 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.5 mmtm 62.82 61.69 1.13 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.832 176.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.915 ' HD2' ' HB2' ' A' ' 33' ' ' ASN . 0.8 OUTLIER -122.74 123.34 40.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.56 176.3 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 1.063 HG21 ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -105.23 117.41 33.93 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.692 179.809 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.417 HG23 ' O ' ' A' ' 28' ' ' PHE . 1.8 t -125.49 130.97 52.84 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.892 0.377 . . . . 0.0 110.247 177.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.508 ' HA ' ' CB ' ' A' ' 27' ' ' PHE . 11.2 m-85 -78.53 -17.25 56.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.023 -177.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -112.88 166.47 11.36 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 120.87 0.366 . . . . 0.0 111.009 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -59.67 119.36 39.71 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.695 -177.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.506 ' HD3' ' CD2' ' A' ' 28' ' ' PHE . 97.4 Cg_endo -91.38 21.9 0.75 Allowed 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 123.236 2.624 . . . . 0.0 112.579 -179.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -118.44 2.18 11.82 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.929 0.395 . . . . 0.0 110.746 177.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.9 mt -77.95 -78.48 0.14 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.192 -177.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -97.91 8.77 44.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.09 0.471 . . . . 0.0 110.97 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.446 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 94.0 m-85 -100.61 61.64 1.02 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.37 0.605 . . . . 0.0 110.31 -177.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.05 179.21 7.64 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.32 -0.854 . . . . 0.0 108.884 177.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -80.79 56.53 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.498 0.666 . . . . 0.0 109.651 176.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -156.39 -178.61 7.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.608 -175.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -79.37 -68.09 0.69 Allowed 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 175.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 177.57 102.15 0.12 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.865 175.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -62.23 96.27 0.15 Allowed 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.679 2.253 . . . . 0.0 111.373 176.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -102.03 105.02 15.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.454 -174.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.02 119.04 51.22 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.848 177.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo . . . . . 0 C--O 1.249 1.061 0 C-N-CA 122.86 2.374 . . . . 0.0 112.186 -179.62 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.664 0 N-CA-C 111.846 -0.502 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.5 m 56.33 -145.97 0.59 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.602 0.239 . . . . 0.0 110.832 -178.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -167.12 156.33 10.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.439 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.487 ' H ' ' HG3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -105.33 87.92 2.73 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.241 0.543 . . . . 0.0 109.543 175.349 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.49 -19.11 13.04 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.863 -177.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.32 73.25 10.16 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.784 -178.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.519 ' HG3' HG23 ' A' ' 8' ' ' VAL . 0.0 OUTLIER -64.16 -29.28 70.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.157 0.503 . . . . 0.0 110.028 175.708 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.519 HG23 ' HG3' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -94.77 72.36 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.613 174.11 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.79 138.28 41.09 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.981 -178.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -84.57 137.86 16.26 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.987 179.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -73.78 -177.21 2.69 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.922 0.391 . . . . 0.0 110.125 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.41 HD11 ' CD1' ' A' ' 28' ' ' PHE . 17.1 mt -96.01 156.74 36.79 Favored Pre-proline 0 C--N 1.313 -1.002 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.121 -171.091 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.498 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 76.8 Cg_exo -55.21 177.86 0.1 Allowed 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.6 2.867 . . . . 0.0 112.885 172.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -65.07 -43.12 93.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.54 -176.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.37 -28.94 72.02 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.249 -0.501 . . . . 0.0 112.613 -176.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.498 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 92.8 m95 -83.74 146.91 27.93 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -129.32 138.54 51.64 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.321 175.09 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -93.13 101.18 13.47 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.582 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 2.0 mt-10 -106.1 164.06 12.29 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.053 -178.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 12.7 m -125.65 134.28 51.92 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.018 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.67 172.94 10.5 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 121.269 0.556 . . . . 0.0 110.053 179.021 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.93 -27.14 67.95 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.484 -173.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -76.98 -36.89 56.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.311 0.577 . . . . 0.0 109.68 177.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 126.79 7.6 5.07 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.891 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -78.02 116.43 18.5 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 176.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.2 p -74.14 154.76 6.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-O 121.176 0.513 . . . . 0.0 110.209 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.521 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 51.9 p90 -164.74 159.76 19.02 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.542 -0.753 . . . . 0.0 110.416 -177.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.41 ' CD1' HD11 ' A' ' 12' ' ' LEU . 6.9 m-85 -114.39 130.66 56.71 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.71 -176.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.868 ' HB ' HG22 ' A' ' 36' ' ' THR . 0.1 OUTLIER -130.93 127.57 61.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 121.174 0.512 . . . . 0.0 110.08 176.816 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.654 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -75.38 136.17 40.78 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 173.762 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.4 m-70 -107.63 28.67 7.94 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.26 0.553 . . . . 0.0 111.429 -176.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.3 mm -107.95 -54.91 5.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 171.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.491 ' O ' ' HB2' ' A' ' 34' ' ' LYS . 59.3 m-80 -95.13 -28.51 15.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.835 177.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.654 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.1 OUTLIER 79.49 53.21 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.237 174.12 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.38 131.76 54.77 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.448 174.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.868 HG22 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -96.5 125.81 41.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.852 -178.271 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.7 t -125.77 138.17 53.84 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.928 0.394 . . . . 0.0 110.104 175.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -89.16 -8.18 54.19 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.531 178.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.51 157.51 21.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.39 179.186 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.613 ' OD1' ' HB2' ' A' ' 42' ' ' ARG . 12.2 t70 -68.12 131.63 92.11 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.6 -177.091 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.55 ' O ' ' HB2' ' A' ' 45' ' ' PHE . 3.3 Cg_exo -77.25 5.05 5.35 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 122.928 2.418 . . . . 0.0 114.087 -175.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.613 ' HB2' ' OD1' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -76.41 -14.51 60.06 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 122.025 -0.422 . . . . 0.0 111.921 -178.369 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 mt -86.93 -82.26 0.21 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.828 0.347 . . . . 0.0 111.6 -176.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.33 -0.33 54.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.254 0.55 . . . . 0.0 112.093 -172.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.55 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 20.0 m-85 -117.51 -3.31 11.37 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.294 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.507 ' HB ' ' H ' ' A' ' 47' ' ' VAL . 0.2 OUTLIER 57.0 -114.12 0.8 Allowed 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.022 -176.463 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.507 ' H ' ' HB ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -152.95 122.37 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.831 0.348 . . . . 0.0 110.58 179.069 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -92.91 20.25 6.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.296 0.57 . . . . 0.0 110.044 176.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -105.07 -83.37 0.51 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.361 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -143.44 128.84 9.92 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.908 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -81.89 -26.29 3.08 Favored 'Trans proline' 0 CA--C 1.533 0.459 0 C-N-CA 122.866 2.377 . . . . 0.0 113.97 -175.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.7 m 65.8 86.24 0.13 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.167 0.508 . . . . 0.0 110.896 -173.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.37 126.55 35.66 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.963 -179.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo . . . . . 0 C--O 1.252 1.181 0 C-N-CA 122.59 2.193 . . . . 0.0 112.58 179.464 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.25 14.04 8.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.981 0.42 . . . . 0.0 111.559 -178.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -87.46 -67.69 0.8 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.937 0.399 . . . . 0.0 110.17 177.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -126.76 74.41 1.48 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.392 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.7 ttt-85 -75.48 100.5 4.53 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 175.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -76.63 6.11 6.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.634 -175.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 7' ' ' ARG . 9.4 mtt-85 -118.33 85.11 2.29 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 174.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.36 53.31 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.1 -175.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.6 50.24 1.62 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.321 0.582 . . . . 0.0 110.561 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -88.05 143.82 18.35 Favored Glycine 0 N--CA 1.447 -0.603 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.498 -176.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.49 134.47 50.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.487 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 24.3 mt -85.75 152.69 57.24 Favored Pre-proline 0 C--N 1.318 -0.798 0 CA-C-O 120.926 0.393 . . . . 0.0 111.474 -176.265 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.542 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 32.6 Cg_exo -61.27 169.87 5.85 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.167 2.578 . . . . 0.0 112.515 174.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.59 -40.03 62.23 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.335 -0.848 . . . . 0.0 113.169 -173.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -83.33 -12.3 78.93 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.39 -0.909 . . . . 0.0 113.68 -175.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.542 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 87.6 m95 -92.27 137.97 31.92 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -172.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -120.45 141.69 49.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.542 174.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.718 HE21 ' HE1' ' A' ' 28' ' ' PHE . 20.4 tt0 -92.84 104.2 16.48 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.537 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.7 mt-10 -114.67 168.63 9.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.648 -176.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.24 140.57 51.86 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.205 176.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.428 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -77.53 -176.56 4.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.191 0.52 . . . . 0.0 110.349 179.846 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.7 -26.37 66.14 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.427 -176.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.428 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 16.6 m-80 -84.44 -43.16 14.91 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.083 0.468 . . . . 0.0 110.842 -178.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 131.2 16.5 1.54 Allowed Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.906 -0.664 . . . . 0.0 111.854 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.0 126.96 35.64 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 174.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.405 HG22 ' O ' ' A' ' 19' ' ' GLU . 1.0 OUTLIER -80.05 152.1 4.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.352 0.596 . . . . 0.0 110.849 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.537 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 54.1 p90 -157.63 166.03 33.94 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.704 -178.092 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.718 ' HE1' HE21 ' A' ' 18' ' ' GLN . 7.7 m-85 -118.34 134.96 54.61 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.703 -179.061 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.531 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -129.45 124.94 60.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-O 121.138 0.494 . . . . 0.0 111.0 -179.828 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.616 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 2.6 t0 -73.56 114.06 11.38 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 171.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -86.99 0.27 55.45 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.749 -0.38 . . . . 0.0 112.012 -172.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -79.42 -49.51 19.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -101.16 -11.39 19.59 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.279 -178.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.67 58.98 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.181 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.616 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -122.29 125.68 46.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.689 179.27 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -96.93 129.35 44.39 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.001 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.1 t -125.51 132.22 52.67 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 172.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -93.02 0.05 57.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.453 0.644 . . . . 0.0 109.998 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.738 HD21 ' HG ' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -116.65 159.53 22.06 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.26 173.44 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.636 ' OD1' ' HB2' ' A' ' 42' ' ' ARG . 16.1 t70 -69.59 131.47 89.78 Favored Pre-proline 0 C--N 1.319 -0.731 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.653 -174.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.619 ' HA ' ' CD1' ' A' ' 45' ' ' PHE . 8.0 Cg_exo -74.79 29.83 0.35 Allowed 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 123.335 2.69 . . . . 0.0 114.021 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.636 ' HB2' ' OD1' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -105.59 -21.94 13.09 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 122.325 -0.234 . . . . 0.0 110.883 174.614 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.738 ' HG ' HD21 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -66.7 -93.24 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.837 -174.304 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.1 8.76 16.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.233 0.54 . . . . 0.0 111.187 -175.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.619 ' CD1' ' HA ' ' A' ' 41' ' ' PRO . 15.4 m-85 -104.21 1.97 31.19 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.86 -177.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.528 HG21 ' HB3' ' A' ' 51' ' ' PRO . 23.8 m -138.61 135.91 35.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.943 178.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 35.9 m -99.35 15.45 4.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.971 0.415 . . . . 0.0 111.276 -177.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -130.65 165.74 22.18 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.274 -178.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -66.62 -34.95 79.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.464 0.649 . . . . 0.0 109.77 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -133.8 118.26 14.35 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.753 176.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.528 ' HB3' HG21 ' A' ' 46' ' ' THR . 13.8 Cg_endo -59.01 142.54 99.51 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.563 2.175 . . . . 0.0 111.901 177.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.51 108.29 1.62 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.347 -177.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.2 tttm -108.87 130.26 22.94 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.853 -178.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo . . . . . 0 C--O 1.251 1.136 0 C-N-CA 123.112 2.541 . . . . 0.0 111.835 176.777 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 N-CA-C 111.742 -0.543 . . . . 0.0 111.742 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.87 -42.13 61.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.948 0.404 . . . . 0.0 110.87 -177.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.41 132.63 40.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.446 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.8 mttp -123.1 77.65 1.49 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.212 0.53 . . . . 0.0 110.01 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 8.9 mtm180 -77.82 147.13 35.36 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.442 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -92.98 7.68 43.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.51 -176.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.95 46.64 0.64 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.531 177.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -143.22 156.61 17.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.295 174.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.09 -69.48 0.5 Allowed 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.431 -175.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.15 -49.83 3.84 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.709 -178.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -63.73 -44.91 92.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.276 0.56 . . . . 0.0 109.612 173.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.9 mt -87.34 160.93 47.35 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.272 176.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.543 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.9 Cg_exo -56.17 173.26 0.46 Allowed 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.844 2.362 . . . . 0.0 112.251 172.115 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.443 ' CE2' HD12 ' A' ' 32' ' ' ILE . 0.9 OUTLIER -61.46 -39.38 90.66 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.837 -173.131 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -75.92 -24.7 68.7 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.919 -0.657 . . . . 0.0 114.062 -175.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.543 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 88.2 m95 -82.42 138.2 34.49 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -171.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.435 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -118.19 153.56 33.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.834 175.369 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -107.79 106.63 17.01 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.468 178.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.494 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.1 mt-10 -110.78 178.55 4.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.436 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.436 HG21 ' HA2' ' A' ' 24' ' ' GLY . 0.2 OUTLIER -126.19 138.13 53.62 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.477 179.398 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.507 ' OD1' ' HG3' ' A' ' 22' ' ' GLU . 0.8 OUTLIER -107.86 179.24 4.28 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 -179.056 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.507 ' HG3' ' OD1' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -26.4 -78.6 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -166.767 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -88.35 35.44 0.76 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.166 0.507 . . . . 0.0 111.915 -170.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.436 ' HA2' HG21 ' A' ' 20' ' ' THR . . . 82.51 4.84 89.97 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.888 -0.672 . . . . 0.0 111.486 178.164 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -61.14 113.93 2.85 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.36 -0.42 . . . . 0.0 109.917 177.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.3 p -78.7 153.25 4.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.201 0.524 . . . . 0.0 110.752 -179.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.494 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 53.9 p90 -157.94 161.18 38.19 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.906 177.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.446 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 15.2 m-85 -116.97 137.13 52.42 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.089 -175.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.662 ' HB ' HG21 ' A' ' 36' ' ' THR . 0.2 OUTLIER -129.54 121.03 52.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.342 0.591 . . . . 0.0 111.344 -178.652 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.689 ' HB3' ' HG2' ' A' ' 35' ' ' ARG . 43.0 t0 -78.31 117.22 19.34 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.722 -1.127 . . . . 0.0 108.958 177.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.435 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 73.7 m-70 -89.39 -4.07 58.19 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.815 0.34 . . . . 0.0 111.17 -176.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.443 HD12 ' CE2' ' A' ' 14' ' ' TYR . 17.7 mm -95.79 -42.79 12.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.195 0.521 . . . . 0.0 110.048 175.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.514 ' CB ' ' HD3' ' A' ' 35' ' ' ARG . 69.5 m-80 -98.13 -7.43 29.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.002 -179.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.01 51.59 2.8 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.404 173.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.689 ' HG2' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -125.9 142.3 51.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.679 0.276 . . . . 0.0 111.472 177.026 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.662 HG21 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -111.15 119.17 38.07 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.262 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 39' ' ' LEU . 15.3 t -125.25 137.7 54.1 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.056 0.455 . . . . 0.0 110.891 178.576 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -91.65 3.81 54.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.898 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.417 ' O ' HG22 ' A' ' 37' ' ' THR . 0.6 OUTLIER -119.92 163.92 16.84 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.832 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.494 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 2.7 t70 -70.79 122.54 87.1 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.567 -177.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 40' ' ' ASP . 9.1 Cg_endo -89.99 32.74 0.35 Allowed 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 123.23 2.62 . . . . 0.0 112.687 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -115.99 -41.86 3.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.726 -0.216 . . . . 0.0 110.724 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 7.1 mt -55.96 -81.06 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.475 -178.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -106.12 13.28 29.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.115 0.483 . . . . 0.0 111.686 -174.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -103.86 71.75 1.07 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.887 -177.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -83.9 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.338 176.213 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.1 p -118.26 113.48 42.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 173.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -103.97 70.76 1.01 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.443 0.639 . . . . 0.0 110.852 -173.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -98.69 76.05 2.18 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.469 176.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -173.59 156.02 2.69 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -65.65 91.68 0.24 Allowed 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.147 1.898 . . . . 0.0 111.728 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.08 113.92 5.43 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.212 0.53 . . . . 0.0 111.121 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.46 ' HE3' ' HB3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -81.68 128.0 70.76 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.524 -179.815 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo . . . . . 0 C--O 1.25 1.124 0 C-N-CA 122.544 2.163 . . . . 0.0 111.603 175.947 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.729 0 N-CA-C 111.511 -0.636 . . . . 0.0 111.511 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.89 116.31 22.14 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.62 0.21 . . . . 0.0 110.461 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.62 122.4 26.47 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 176.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.3 mttt -80.51 -72.34 0.42 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.87 -176.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.0 mtt180 63.15 -86.68 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.171 0 O-C-N 123.558 0.536 . . . . 0.0 110.653 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.3 ptmt 49.89 22.67 0.89 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.208 1.003 . . . . 0.0 113.321 177.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.57 -58.51 3.86 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.328 0.585 . . . . 0.0 109.525 175.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.14 28.48 3.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.096 174.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -123.19 171.01 9.66 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.302 -177.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -75.31 154.34 45.93 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.492 -178.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -81.75 -16.3 51.52 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.227 0.537 . . . . 0.0 110.888 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.755 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 0.3 OUTLIER -88.39 165.67 27.2 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.78 -169.835 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.443 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 47.4 Cg_exo -60.6 -168.73 0.05 OUTLIER 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.826 3.017 . . . . 0.0 112.475 169.376 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.45 -45.32 72.83 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.011 -174.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -82.02 -21.96 60.19 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.64 -0.791 . . . . 0.0 113.157 -175.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.755 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 85.6 m95 -83.28 144.89 29.42 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -171.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.413 ' HB2' ' HD2' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -124.73 146.83 48.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.115 174.185 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.498 ' HB2' ' CD2' ' A' ' 12' ' ' LEU . 28.0 tt0 -100.6 100.96 11.75 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.599 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 5.0 mt-10 -108.91 168.17 9.55 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.102 0.477 . . . . 0.0 110.99 -175.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -114.28 137.62 51.56 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.549 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -176.14 4.92 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.097 0.475 . . . . 0.0 110.677 -179.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -70.45 -30.0 66.72 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.248 -175.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -78.34 -43.77 26.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.185 0.517 . . . . 0.0 109.764 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 128.74 25.78 0.99 Allowed Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.998 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.7 149.36 23.4 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 174.061 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.443 HG21 ' O ' ' A' ' 19' ' ' GLU . 1.4 p -90.49 156.07 3.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.35 0.595 . . . . 0.0 110.653 -179.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.599 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 46.0 p90 -161.05 163.72 31.37 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.592 178.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.442 ' CD1' HD21 ' A' ' 12' ' ' LEU . 14.3 m-85 -117.2 131.42 56.87 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.484 -176.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.862 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.46 122.04 46.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.329 0.585 . . . . 0.0 110.791 179.519 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.532 ' HA ' ' HA ' ' A' ' 16' ' ' TRP . 0.0 OUTLIER -77.83 126.62 31.12 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 172.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.413 ' HD2' ' HB2' ' A' ' 17' ' ' GLU . 64.5 m-70 -99.56 9.5 43.08 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.39 -174.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.472 HD11 HG23 ' A' ' 32' ' ' ILE . 3.5 mm -94.2 -49.34 12.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.093 0.473 . . . . 0.0 109.891 175.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -108.96 -1.52 18.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.648 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm 64.72 65.41 0.62 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 170.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.589 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -123.72 134.12 53.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.565 0.222 . . . . 0.0 111.094 173.856 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.862 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -112.1 118.75 36.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.664 179.413 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.8 t -125.98 136.84 53.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.775 0.321 . . . . 0.0 110.517 176.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -87.28 -7.23 58.08 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.062 0.458 . . . . 0.0 110.659 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.8 164.42 13.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.759 176.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.51 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 9.7 t70 -63.73 128.04 92.29 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.858 -176.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.51 ' HD3' ' HA ' ' A' ' 40' ' ' ASP . 6.3 Cg_exo -73.82 -13.89 24.21 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 122.774 2.316 . . . . 0.0 113.22 -174.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.8 mtm180 -87.45 12.31 12.51 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.686 -173.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.3 mt -79.11 -82.72 0.1 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.754 177.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -102.54 -0.07 32.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.122 0.487 . . . . 0.0 111.204 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -119.0 -172.2 2.25 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.361 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.7 m 60.04 54.14 4.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.685 176.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.76 84.99 2.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.012 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.19 -60.62 2.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.316 -173.245 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -128.53 176.27 7.89 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.43 -177.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.2 t30 -103.62 125.33 35.11 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 116.297 -0.411 . . . . 0.0 109.969 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -55.07 134.47 63.94 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 123.09 2.526 . . . . 0.0 112.775 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.8 134.17 54.43 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.28 177.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.409 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 2.1 mttm -67.87 132.12 92.38 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.78 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 2.6 Cg_exo . . . . . 0 C--O 1.248 1.021 0 C-N-CA 122.977 2.451 . . . . 0.0 111.598 176.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.822 0 N-CA-C 111.642 -0.583 . . . . 0.0 111.642 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.87 95.29 0.68 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.896 0.348 . . . . 0.0 110.143 177.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -82.11 51.97 1.89 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.749 -173.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.4 122.57 43.37 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 175.081 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -10.53 59.52 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.102 -174.144 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.64 -122.53 0.94 Allowed 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.389 -175.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? 53.98 37.63 27.16 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.111 0.482 . . . . 0.0 110.715 177.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.536 ' HB ' ' HG3' ' A' ' 13' ' ' PRO . 13.8 m -85.6 104.21 13.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.653 0.739 . . . . 0.0 110.418 -176.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.04 119.48 24.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.493 -175.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 111.92 -150.67 18.1 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.429 176.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.449 ' HB3' ' H ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -88.11 -87.54 0.15 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 175.765 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.603 HD13 ' HB2' ' A' ' 18' ' ' GLN . 14.5 mt -86.67 135.0 36.42 Favored Pre-proline 0 N--CA 1.427 -1.596 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 169.014 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.536 ' HG3' ' HB ' ' A' ' 8' ' ' VAL . 26.9 Cg_exo -63.15 168.26 11.16 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.479 2.119 . . . . 0.0 112.065 178.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.53 -39.45 80.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.688 -174.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -80.22 -20.79 66.39 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.553 -0.832 . . . . 0.0 113.047 -176.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.53 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 79.8 m95 -86.24 138.95 31.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.402 0.62 . . . . 0.0 112.36 -176.362 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -122.8 143.59 49.74 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.011 175.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.603 ' HB2' HD13 ' A' ' 12' ' ' LEU . 8.4 tt0 -93.42 110.55 22.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.074 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.64 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 2.3 mt-10 -119.92 165.28 14.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.515 -178.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.3 m -121.61 133.89 55.0 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.573 177.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.77 -177.8 6.81 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.255 0.55 . . . . 0.0 111.075 -176.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.97 -18.06 62.02 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.931 -174.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -88.5 -8.36 54.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.339 0.59 . . . . 0.0 109.563 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.1 19.05 58.24 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.06 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -97.44 135.63 39.03 Favored 'General case' 0 N--CA 1.438 -1.038 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 176.194 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 19' ' ' GLU . 2.0 p -78.47 151.01 5.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.717 0.77 . . . . 0.0 111.084 -179.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.64 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 50.8 p90 -150.84 160.85 43.61 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.135 177.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -116.55 137.93 51.8 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.642 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.53 126.52 55.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 CA-C-O 121.294 0.568 . . . . 0.0 111.492 -179.079 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.537 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 4.8 t70 -77.33 123.61 26.73 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.914 -1.039 . . . . 0.0 108.46 172.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 73.1 m-70 -98.73 9.11 44.06 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.322 -175.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.477 HD11 HG23 ' A' ' 32' ' ' ILE . 13.6 mm -91.27 -57.03 4.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.911 178.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.61 1.5 19.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.177 178.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.537 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 12.2 mptt 67.03 72.47 0.36 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.317 -0.856 . . . . 0.0 113.084 168.381 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.452 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.2 OUTLIER -123.84 120.31 32.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.573 172.172 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.642 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -97.57 117.1 31.07 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.235 176.309 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.7 t -125.63 131.9 52.58 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.856 0.36 . . . . 0.0 110.761 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -79.87 -15.7 56.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.373 0.606 . . . . 0.0 109.699 178.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -102.52 161.5 13.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.834 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.604 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 55.5 t0 -75.96 118.24 69.71 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.349 -175.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -90.66 20.84 0.92 Allowed 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.774 2.316 . . . . 0.0 112.443 176.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.506 ' HB3' HH11 ' A' ' 42' ' ' ARG . 1.3 ttp-105 -115.92 -8.25 11.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.544 175.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.604 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 27.8 mt -51.47 -72.62 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.892 -0.594 . . . . 0.0 112.037 -176.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -104.81 31.52 4.72 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.415 0.626 . . . . 0.0 110.663 -178.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -109.23 -78.32 0.59 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.483 -177.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.453 ' HB ' HG23 ' A' ' 8' ' ' VAL . 3.5 m -142.23 97.58 3.15 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.573 178.391 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 3.4 p -107.86 0.75 9.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.242 0.544 . . . . 0.0 110.147 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -91.46 7.74 39.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.372 -177.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.7 t70 73.3 -57.99 0.61 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.622 0.769 . . . . 0.0 112.362 173.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 58.11 70.34 1.28 Allowed Pre-proline 0 N--CA 1.468 0.436 0 C-N-CA 122.657 0.383 . . . . 0.0 111.069 -179.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -84.3 -12.86 7.76 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.853 2.368 . . . . 0.0 112.825 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.97 160.54 29.08 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.943 -174.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.4 ttpm? -128.6 78.86 75.28 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.292 174.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo . . . . . 0 C--O 1.247 0.949 0 C-N-CA 123.171 2.581 . . . . 0.0 112.494 -177.096 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.649 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -91.12 -17.36 26.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.03 0.443 . . . . 0.0 110.323 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -69.52 104.93 2.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.204 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.437 ' HZ1' ' CG ' ' A' ' 11' ' ' ASP . 0.2 OUTLIER -92.31 -79.96 0.37 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.182 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.424 ' H ' ' HB3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER 73.0 -49.65 0.7 Allowed 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.49 0.716 . . . . 0.0 112.347 173.065 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.32 108.49 3.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.222 0.534 . . . . 0.0 111.811 -175.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.436 ' NH2' ' HB2' ' A' ' 11' ' ' ASP . 0.4 OUTLIER -84.05 65.82 8.91 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.941 177.305 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 1.4 p -78.48 -44.58 26.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.875 -175.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -145.55 177.99 8.45 Favored 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 110.383 -0.229 . . . . 0.0 110.383 -177.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.28 131.55 52.11 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.696 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.437 ' CG ' ' HZ1' ' A' ' 4' ' ' LYS . 1.6 t70 -98.12 179.64 4.69 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.117 0.485 . . . . 0.0 110.436 -178.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.455 HD11 ' CD1' ' A' ' 28' ' ' PHE . 0.8 OUTLIER -97.45 169.08 9.1 Favored Pre-proline 0 C--N 1.314 -0.962 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.615 -175.509 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.5 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 72.9 Cg_exo -54.75 173.65 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 123.17 2.58 . . . . 0.0 112.551 170.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -65.15 -39.84 93.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.196 -174.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.15 -28.82 73.21 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.398 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.5 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 89.6 m95 -83.66 122.0 28.03 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.935 0.716 . . . . 0.0 112.935 -174.271 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -101.87 130.51 48.36 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.009 174.131 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.453 ' HB2' HD12 ' A' ' 12' ' ' LEU . 54.4 tt0 -85.01 100.19 11.5 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.039 0.447 . . . . 0.0 110.191 177.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.592 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 2.0 mm-40 -106.91 173.62 6.24 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.732 -176.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 8.0 m -126.39 139.45 53.26 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.241 175.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.437 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -83.74 177.51 8.33 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.17 0.51 . . . . 0.0 110.296 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.41 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -70.71 -23.69 62.51 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.368 -174.978 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.437 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 41.1 m-80 -83.96 -11.28 57.08 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.241 0.543 . . . . 0.0 110.39 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 95.48 12.51 53.82 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.473 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -81.57 139.56 35.0 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 174.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -86.45 149.37 4.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.854 176.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.413 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 44.1 p90 -157.54 158.13 35.08 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.095 -0.957 . . . . 0.0 109.984 -179.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.455 ' CD1' HD11 ' A' ' 12' ' ' LEU . 10.5 m-85 -114.97 131.98 56.73 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.205 -175.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 1.039 ' HB ' HG21 ' A' ' 36' ' ' THR . 0.1 OUTLIER -129.35 120.53 51.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-O 121.614 0.721 . . . . 0.0 111.113 178.532 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -73.01 120.72 19.03 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.545 173.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -93.75 1.38 56.53 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.897 0.38 . . . . 0.0 110.463 -178.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.44 HD13 HG22 ' A' ' 32' ' ' ILE . 6.2 mm -101.81 -51.92 8.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.382 0.611 . . . . 0.0 109.632 175.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -89.11 -11.18 44.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.725 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.433 ' HD2' ' HA ' ' A' ' 34' ' ' LYS . 2.6 mmmm 62.64 57.08 1.87 Allowed 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.266 0.626 . . . . 0.0 112.564 175.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.563 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -124.57 125.68 44.57 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.303 175.638 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 1.039 HG21 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -102.08 115.64 30.98 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 174.562 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.6 t -126.09 134.44 51.37 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.803 0.335 . . . . 0.0 110.581 177.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -84.2 -4.38 58.78 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.04 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -121.61 166.7 13.83 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.96 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -68.91 125.39 91.88 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.901 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.496 ' C ' ' H ' ' A' ' 43' ' ' LEU . 85.3 Cg_endo -90.78 -144.68 0.02 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.832 0 C-N-CA 122.513 2.142 . . . . 0.0 110.572 173.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.419 ' H ' ' HB2' ' A' ' 41' ' ' PRO . 0.0 OUTLIER 64.56 -22.05 0.07 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 179.708 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.66 ' N ' HD23 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -60.81 -89.42 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.2 0.524 . . . . 0.0 111.392 -179.312 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -105.03 4.98 32.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.665 0.745 . . . . 0.0 110.674 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.419 ' CD2' ' HA ' ' A' ' 41' ' ' PRO . 0.0 OUTLIER -117.51 39.48 3.3 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.859 -177.965 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.51 -61.52 1.95 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.074 -0.966 . . . . 0.0 112.135 -175.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 4.6 p -94.24 75.55 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.689 0.757 . . . . 0.0 111.686 -172.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.0 t70 68.39 -73.35 0.09 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 114.627 -1.17 . . . . 0.0 113.545 169.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -69.55 126.64 30.34 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -164.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.423 ' ND2' ' HD2' ' A' ' 51' ' ' PRO . 18.2 t-20 -174.23 133.99 0.56 Allowed Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 114.241 -1.345 . . . . 0.0 108.133 173.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.423 ' HD2' ' ND2' ' A' ' 50' ' ' ASN . 1.7 Cg_endo -43.07 102.02 0.04 OUTLIER 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.737 2.958 . . . . 0.0 112.999 -178.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.66 85.08 2.11 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.202 -178.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.0 107.82 47.33 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.798 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo . . . . . 0 C--O 1.25 1.084 0 C-N-CA 122.985 2.456 . . . . 0.0 111.26 176.961 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.851 0 N-CA-C 111.997 -0.441 . . . . 0.0 111.997 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 m -80.8 65.86 6.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.01 0.433 . . . . 0.0 111.381 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.39 64.27 8.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.551 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -128.9 63.66 1.47 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.663 179.751 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 71.68 136.97 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 O-C-N 123.928 0.767 . . . . 0.0 110.837 -175.35 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.6 mtmt -120.33 161.47 21.09 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.567 -176.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.7 ttm-85 64.01 46.75 3.64 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.765 -179.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.97 49.76 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.073 -179.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 76.1 156.01 0.17 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.445 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -156.9 74.04 0.23 Allowed Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.12 -14.48 57.66 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.012 0.434 . . . . 0.0 111.673 -174.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.608 HD12 ' CD1' ' A' ' 28' ' ' PHE . 19.9 mt -83.61 156.12 65.26 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.025 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.544 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 51.0 Cg_exo -57.28 168.33 2.86 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 122.911 2.408 . . . . 0.0 112.312 174.093 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.86 -39.23 68.41 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.736 -0.665 . . . . 0.0 112.212 -174.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . 0.466 ' CA ' HD12 ' A' ' 32' ' ' ILE . . . -77.98 -22.73 68.08 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.4 -176.156 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.544 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 92.0 m95 -88.41 131.0 35.03 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -173.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.416 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 15.7 mm-40 -112.61 140.06 47.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.34 174.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.656 HE21 ' HE1' ' A' ' 28' ' ' PHE . 32.3 tt0 -93.27 104.16 16.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.028 0.442 . . . . 0.0 110.164 179.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 4.1 mt-10 -109.81 168.45 9.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.713 -177.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.8 m -125.63 134.02 52.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.127 175.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.13 -176.51 5.16 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.188 0.518 . . . . 0.0 110.865 -177.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.42 -32.41 73.27 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.472 -177.42 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -77.75 -23.58 49.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.265 0.555 . . . . 0.0 110.276 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 104.26 14.88 23.09 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.512 -178.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -84.76 137.95 32.9 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 174.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.1 p -84.88 153.96 3.58 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-O 121.476 0.655 . . . . 0.0 110.229 177.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 50.0 p90 -160.19 161.65 33.64 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.47 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.656 ' HE1' HE21 ' A' ' 18' ' ' GLN . 12.5 m-85 -119.38 135.99 54.48 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.388 -176.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.836 ' HB ' HG21 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.1 121.97 50.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.691 179.871 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.798 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 7.0 t0 -75.1 118.61 18.24 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 171.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.416 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 28.0 m-70 -87.52 -4.22 58.98 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -171.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.466 HD12 ' CA ' ' A' ' 15' ' ' GLY . 4.4 mt -86.96 -42.79 15.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.947 0.403 . . . . 0.0 110.378 176.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.4 m-80 -101.95 -5.74 24.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.077 179.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.44 58.94 3.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.06 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.798 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 1.3 ptt180 -121.57 121.01 36.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.745 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.836 HG21 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -101.78 120.71 40.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.928 -178.813 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.6 t -126.11 137.83 53.63 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.693 0.282 . . . . 0.0 110.486 175.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -89.15 -3.83 58.48 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.21 0.528 . . . . 0.0 109.976 177.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.17 156.85 18.03 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.989 175.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.404 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 5.5 t0 -78.13 121.09 83.47 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.213 -175.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.458 ' HA ' ' CD2' ' A' ' 45' ' ' PHE . 1.9 Cg_endo -81.67 53.74 4.78 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.259 2.639 . . . . 0.0 111.969 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.54 -44.8 2.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.524 -177.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.425 ' H ' ' CD2' ' A' ' 43' ' ' LEU . 0.2 OUTLIER -58.55 -76.94 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.907 0.384 . . . . 0.0 111.992 -175.713 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -102.69 11.53 37.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.038 0.447 . . . . 0.0 111.371 -177.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.458 ' CD2' ' HA ' ' A' ' 41' ' ' PRO . 49.0 m-85 -118.42 133.75 55.62 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.355 -176.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 3.8 p -107.57 -124.73 0.24 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 172.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -95.53 -9.65 9.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 165.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -107.68 151.87 25.08 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.019 -178.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -88.86 171.23 10.07 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.348 -174.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -102.17 125.05 37.72 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.917 178.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.84 45.06 1.56 Allowed 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 122.917 2.411 . . . . 0.0 112.786 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.563 HG22 ' HE2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER 54.59 -106.17 0.3 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.584 -179.522 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.563 ' HE2' HG22 ' A' ' 52' ' ' THR . 0.0 OUTLIER -169.25 165.55 6.51 Favored Pre-proline 0 C--N 1.328 -0.357 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 -179.106 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo . . . . . 0 C--O 1.249 1.068 0 C-N-CA 122.148 1.898 . . . . 0.0 112.168 176.069 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.828 0 N-CA-C 112.105 -0.398 . . . . 0.0 112.105 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.8 106.71 12.02 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 179.651 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.65 59.55 3.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.34 0.591 . . . . 0.0 111.041 -179.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.63 122.5 11.98 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.373 178.619 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.497 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 1.8 ttm105 -61.25 126.22 26.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.462 -177.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.666 ' HB3' HG22 ' A' ' 8' ' ' VAL . 18.6 mtmt 74.27 -26.8 0.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.804 0.69 . . . . 0.0 111.591 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.471 ' H ' ' C ' ' A' ' 5' ' ' ARG . 5.1 ttp180 61.98 23.98 14.21 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.1 0.56 . . . . 0.0 111.006 -178.176 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.666 HG22 ' HB3' ' A' ' 6' ' ' LYS . 85.2 t -82.13 98.38 4.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.222 0.534 . . . . 0.0 110.353 -179.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -95.26 -23.39 17.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.655 177.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.56 112.08 3.3 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.599 -177.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -53.48 145.21 15.2 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 121.881 0.848 . . . . 0.0 111.725 -177.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.469 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 35.3 mt -76.7 157.31 82.2 Favored Pre-proline 0 C--N 1.307 -1.256 0 CA-C-N 114.281 -1.327 . . . . 0.0 112.087 -173.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.516 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 31.3 Cg_exo -61.09 -172.47 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 123.357 2.704 . . . . 0.0 113.336 176.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -54.56 45.68 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.416 -172.366 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -78.23 -17.26 78.39 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.615 -0.721 . . . . 0.0 113.315 -173.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.516 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 92.6 m95 -85.35 133.65 34.13 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.514 0.673 . . . . 0.0 112.735 -170.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -120.42 135.9 54.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.578 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -85.12 109.44 18.26 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.602 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.1 mm-40 -118.35 166.99 11.98 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.421 -176.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.8 m -127.69 135.38 50.11 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.87 173.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.73 -178.23 5.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.369 0.604 . . . . 0.0 110.917 -177.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -32.08 73.38 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.309 -175.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -74.29 -41.66 60.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.436 0.636 . . . . 0.0 110.303 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 125.91 14.05 3.18 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.713 -179.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.39 127.5 34.39 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 175.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.411 HG21 ' O ' ' A' ' 19' ' ' GLU . 0.5 OUTLIER -79.17 151.69 4.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.348 0.594 . . . . 0.0 110.228 178.597 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.5 p90 -162.09 160.61 27.57 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.518 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -115.25 135.62 53.96 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.828 -179.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.772 ' HB ' HG22 ' A' ' 36' ' ' THR . 0.2 OUTLIER -125.68 129.29 72.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.424 0.63 . . . . 0.0 110.981 177.729 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.515 ' HB3' ' CG ' ' A' ' 35' ' ' ARG . 5.2 t0 -77.76 109.76 12.03 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.638 -1.165 . . . . 0.0 108.404 174.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -85.35 9.24 16.01 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.457 -174.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -94.76 -52.63 9.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.902 0.382 . . . . 0.0 110.082 174.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -103.55 -1.43 28.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.233 -178.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.8 mmtp 63.87 61.17 0.98 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.125 0.57 . . . . 0.0 111.981 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.515 ' CG ' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -123.97 135.93 53.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.896 176.886 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.772 HG22 ' HB ' ' A' ' 29' ' ' VAL . 0.5 OUTLIER -107.13 123.68 48.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.006 -179.322 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.406 HG23 ' CZ3' ' A' ' 16' ' ' TRP . 6.8 t -126.53 135.77 51.72 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.943 0.401 . . . . 0.0 110.512 173.122 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -88.55 -1.52 58.1 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.99 0.424 . . . . 0.0 110.512 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.42 165.64 16.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.142 178.326 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.468 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 8.3 t70 -64.65 130.05 94.57 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.741 -179.053 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.51 ' HA ' ' HB2' ' A' ' 45' ' ' PHE . 2.3 Cg_endo -82.95 3.77 7.59 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.252 2.635 . . . . 0.0 114.726 -172.335 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.8 mtt85 -80.46 -11.03 59.73 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.904 -0.497 . . . . 0.0 111.265 -177.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 mt -86.08 -88.54 0.12 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.383 -177.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -105.99 8.39 32.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.76 0.314 . . . . 0.0 111.692 -174.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.51 ' HB2' ' HA ' ' A' ' 41' ' ' PRO . 13.5 m-85 -112.7 21.22 15.79 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.42 0.628 . . . . 0.0 110.866 -174.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.95 -45.96 3.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.807 177.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.4 p -118.02 127.2 75.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.231 178.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.8 t0 73.55 -39.67 0.44 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.863 0.865 . . . . 0.0 111.947 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.449 ' OD2' ' HD2' ' A' ' 51' ' ' PRO . 4.1 t70 68.41 -167.24 0.19 Allowed 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.815 0.446 . . . . 0.0 111.207 176.447 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.648 ' HB3' ' HD3' ' A' ' 51' ' ' PRO . 4.5 t-20 -152.68 -55.25 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.658 -178.288 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.648 ' HD3' ' HB3' ' A' ' 50' ' ' ASN . 47.0 Cg_exo -58.61 -38.83 87.59 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 121.878 1.719 . . . . 0.0 111.142 171.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.448 HG23 ' HD2' ' A' ' 35' ' ' ARG . 0.2 OUTLIER -101.58 46.97 0.92 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.492 178.322 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.61 ' N ' ' HD2' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -73.61 -45.49 7.31 Favored Pre-proline 0 CA--C 1.537 0.472 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.862 177.424 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.61 ' HD2' ' N ' ' A' ' 53' ' ' LYS . 12.2 Cg_endo . . . . . 0 C--O 1.252 1.186 0 C-N-CA 121.981 1.787 . . . . 0.0 112.065 177.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.662 0 N-CA-C 111.681 -0.568 . . . . 0.0 111.681 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.21 -40.92 86.51 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.742 0.306 . . . . 0.0 111.635 -177.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -151.55 84.46 1.3 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.86 0.362 . . . . 0.0 111.301 -176.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -83.98 37.79 0.62 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.189 0.518 . . . . 0.0 110.533 177.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.414 ' HB2' ' H ' ' A' ' 6' ' ' LYS . 1.7 ptt180 -127.76 -150.13 0.43 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.023 -177.33 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.414 ' H ' ' HB2' ' A' ' 5' ' ' ARG . 0.1 OUTLIER 66.28 51.66 1.2 Allowed 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.196 0.522 . . . . 0.0 111.683 176.434 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.428 ' HB3' ' H ' ' A' ' 8' ' ' VAL . 0.1 OUTLIER -122.35 -95.08 0.49 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 172.098 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.428 ' H ' ' HB3' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -151.67 129.79 2.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.759 176.575 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -142.11 72.33 1.38 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.053 0.454 . . . . 0.0 110.88 179.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -69.36 -47.92 48.36 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 110.784 -0.926 . . . . 0.0 110.784 176.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -106.72 -92.79 0.39 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 172.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.458 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 16.0 mt -103.17 156.36 35.47 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 174.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.542 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 39.6 Cg_exo -59.62 163.37 13.26 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.332 2.021 . . . . 0.0 111.499 169.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -56.42 -38.64 71.84 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -173.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.7 -23.67 76.65 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 121.123 -0.561 . . . . 0.0 113.421 -178.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.542 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 87.3 m95 -85.66 129.33 34.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.328 0.585 . . . . 0.0 112.366 -174.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -110.23 139.8 45.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.329 171.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -95.22 107.83 19.94 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.567 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.5 mm-40 -113.47 167.79 10.29 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.932 -174.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.4 m -116.23 140.07 49.69 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 177.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -179.04 7.24 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.026 0.441 . . . . 0.0 110.727 -179.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.48 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -61.74 -32.83 73.1 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.718 -177.36 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -82.53 -43.8 16.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.781 -177.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 136.38 5.81 1.98 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 121.165 -0.541 . . . . 0.0 111.753 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.49 137.8 38.12 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 176.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 19' ' ' GLU . 1.5 p -88.92 152.2 3.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.419 0.628 . . . . 0.0 110.642 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.502 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 45.5 p90 -154.53 161.92 41.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.79 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.432 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 13.0 m-85 -115.64 133.06 56.4 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.862 -176.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.605 ' HA ' ' O ' ' A' ' 35' ' ' ARG . 0.1 OUTLIER -131.42 119.92 44.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.316 0.579 . . . . 0.0 111.234 179.792 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.612 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 5.6 t0 -78.03 110.37 12.91 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 171.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -81.67 -8.12 59.67 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.035 -173.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.487 HG22 HD11 ' A' ' 32' ' ' ILE . 6.6 mm -77.96 -55.96 8.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.249 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -99.03 -0.03 42.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.357 -177.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? 68.6 60.46 0.37 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.861 173.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.612 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -122.71 119.79 31.73 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.286 177.902 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.553 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -107.75 112.79 25.64 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.055 177.389 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.4 t -126.24 130.89 51.81 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.064 0.459 . . . . 0.0 110.908 179.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -82.34 -10.4 59.1 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.591 179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.545 HD23 ' HG ' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -111.17 162.42 14.96 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.061 178.884 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.479 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 10.4 t0 -63.81 123.16 80.69 Favored Pre-proline 0 C--N 1.324 -0.538 0 O-C-N 123.635 0.584 . . . . 0.0 110.94 -176.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.479 ' HD3' ' HA ' ' A' ' 40' ' ' ASP . 23.3 Cg_exo -64.52 -22.31 65.29 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 123.371 2.714 . . . . 0.0 113.325 -175.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.56 -7.31 58.41 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.566 0.21 . . . . 0.0 111.566 -174.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.545 ' HG ' HD23 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -67.87 -93.87 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.027 0.442 . . . . 0.0 112.07 -178.035 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -105.85 1.38 26.8 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -174.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -97.02 -17.82 19.79 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.356 -172.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.4 167.67 10.69 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.062 179.218 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 16.2 m -96.32 -14.28 7.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 171.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.1 t70 57.56 -157.71 0.29 Allowed 'General case' 0 C--O 1.233 0.228 0 CA-C-N 114.605 -1.18 . . . . 0.0 111.787 178.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -133.9 -18.31 2.11 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.047 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -113.55 115.77 46.54 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.971 178.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -78.11 157.58 30.29 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 122.511 2.141 . . . . 0.0 112.538 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -72.62 0.23 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.909 176.282 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.7 ' HB2' ' HD3' ' A' ' 54' ' ' PRO . 19.2 mmtp -140.82 -51.23 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.406 175.229 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.7 ' HD3' ' HB2' ' A' ' 53' ' ' LYS . 5.0 Cg_exo . . . . . 0 C--O 1.248 0.991 0 C-N-CA 122.39 2.06 . . . . 0.0 111.217 171.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.683 0 N-CA-C 111.785 -0.526 . . . . 0.0 111.785 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -146.61 154.03 41.02 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 -178.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -77.36 143.68 38.54 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 177.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.37 -66.32 1.09 Allowed 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.494 -175.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.84 98.15 1.2 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -174.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.518 ' HD2' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -107.26 111.36 23.7 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 170.727 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.81 62.24 6.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.309 -175.542 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.2 t -102.19 -74.56 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.243 -0.435 . . . . 0.0 109.936 177.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -116.89 123.63 47.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.725 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.28 54.87 3.03 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.887 -0.673 . . . . 0.0 113.033 177.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -71.31 -49.8 38.99 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 174.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.443 HD22 ' CD1' ' A' ' 28' ' ' PHE . 0.8 OUTLIER -81.16 170.69 14.48 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.415 175.44 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.567 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 51.3 Cg_exo -56.8 165.67 4.6 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.247 1.965 . . . . 0.0 111.278 170.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -61.58 -38.28 86.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.658 -171.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.63 -25.19 75.79 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.161 -0.542 . . . . 0.0 113.548 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.567 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 86.3 m95 -83.78 144.14 29.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.515 0.674 . . . . 0.0 112.676 -174.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.532 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 2.0 mt-10 -127.29 149.31 50.08 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.095 174.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.586 HE21 ' HE1' ' A' ' 28' ' ' PHE . 35.5 tt0 -96.88 102.89 14.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.697 177.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.492 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.6 mt-10 -105.48 178.86 4.44 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.989 0.423 . . . . 0.0 110.424 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.8 m -131.5 139.58 49.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.325 176.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.52 176.64 9.22 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.338 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.406 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 2.4 pt-20 -67.29 -26.34 66.49 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.771 -174.163 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -84.9 -35.11 22.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.963 0.411 . . . . 0.0 110.219 -179.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 126.15 15.09 2.87 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.216 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -83.52 142.52 30.84 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 174.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.476 HG22 ' O ' ' A' ' 19' ' ' GLU . 0.9 OUTLIER -90.97 154.94 3.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.303 0.573 . . . . 0.0 110.507 179.961 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.431 ' CB ' ' HA ' ' A' ' 38' ' ' TYR . 50.6 p90 -161.96 161.08 28.47 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.264 178.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.586 ' HE1' HE21 ' A' ' 18' ' ' GLN . 14.0 m-85 -116.88 139.96 50.01 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.045 -176.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.52 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.77 123.68 52.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.218 0.532 . . . . 0.0 111.515 -177.916 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -73.03 114.62 11.39 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 170.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.532 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 50.3 m-70 -84.98 -4.13 59.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.789 0.328 . . . . 0.0 111.375 -175.406 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.415 HG23 HD11 ' A' ' 32' ' ' ILE . 4.5 mm -95.97 -49.78 12.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.4 0.619 . . . . 0.0 109.952 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -98.43 -5.89 31.6 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.04 -177.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.16 56.32 1.77 Allowed 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 175.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.511 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -119.13 120.68 37.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.738 177.896 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.52 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -105.0 116.2 31.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.312 179.331 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.2 t -126.05 132.29 51.99 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.673 0.273 . . . . 0.0 110.429 177.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.431 ' HA ' ' CB ' ' A' ' 27' ' ' PHE . 8.2 m-85 -72.87 -25.52 61.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.019 0.438 . . . . 0.0 111.104 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.77 ' HB3' ' HE2' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -106.33 170.4 7.95 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.629 178.513 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -74.71 120.66 82.63 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.594 -175.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.745 ' HA ' ' HB2' ' A' ' 45' ' ' PHE . 45.0 Cg_endo -75.02 3.68 5.41 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 122.802 2.335 . . . . 0.0 113.349 -176.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.41 ' NH1' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -84.87 -6.74 59.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.798 0.333 . . . . 0.0 110.883 178.424 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 69.9 mt -91.85 -101.9 0.11 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.112 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -97.49 4.64 50.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.87 0.366 . . . . 0.0 111.855 -175.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.77 ' HE2' ' HB3' ' A' ' 39' ' ' LEU . 25.5 m-85 -100.44 -0.54 37.88 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.414 -175.379 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.99 144.5 26.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.957 -179.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 12.6 t -68.3 97.65 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.437 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.23 -55.15 0.31 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.499 -0.773 . . . . 0.0 108.928 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -98.34 171.77 7.98 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 168.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -87.58 116.57 66.57 Favored Pre-proline 0 C--N 1.313 -0.991 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 176.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -48.76 118.93 3.76 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.994 2.463 . . . . 0.0 112.489 -176.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.1 41.45 0.52 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.216 0.531 . . . . 0.0 111.55 -177.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt -134.63 81.23 48.35 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 176.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo . . . . . 0 C--O 1.251 1.148 0 C-N-CA 123.221 2.614 . . . . 0.0 112.568 -173.704 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.812 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -131.48 -62.65 0.87 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.621 0.248 . . . . 0.0 110.78 -177.053 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -73.8 123.24 23.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.982 -178.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.59 136.2 36.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.041 -178.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.62 63.4 1.6 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.363 176.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.4 ' HD3' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER 50.24 54.46 11.08 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.545 -174.111 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.9 mtm-85 -83.65 68.07 9.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.736 -170.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 33.0 m -81.53 -18.31 11.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 170.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 65.79 55.74 0.95 Allowed 'General case' 0 C--O 1.234 0.259 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.923 174.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.18 82.39 1.67 Allowed Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 110.103 -1.199 . . . . 0.0 110.103 170.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.12 -171.94 1.87 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.326 0.584 . . . . 0.0 111.351 -171.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.577 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 15.9 mt -86.33 151.09 53.17 Favored Pre-proline 0 C--N 1.317 -0.808 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.463 -174.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.452 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 46.4 Cg_exo -59.25 175.82 0.65 Allowed 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.382 2.722 . . . . 0.0 111.704 170.248 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -64.53 -40.1 94.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.258 -173.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . 0.414 ' CA ' HD13 ' A' ' 32' ' ' ILE . . . -68.1 -29.28 73.32 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.828 -0.701 . . . . 0.0 113.021 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.577 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 92.0 m95 -82.44 132.5 35.21 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -173.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.4 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -115.31 142.24 46.95 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.852 174.758 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.782 HE21 ' HE1' ' A' ' 28' ' ' PHE . 34.2 tt0 -91.22 102.77 15.49 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 176.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.653 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.6 mm-40 -110.57 168.82 9.18 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.296 0.57 . . . . 0.0 111.069 -175.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.1 m -122.99 135.15 54.36 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.661 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.473 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -83.07 -179.1 7.34 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.415 179.567 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -72.61 -15.98 61.73 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.515 -175.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.473 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 38.5 m-80 -88.31 -10.66 48.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.909 0.385 . . . . 0.0 110.314 177.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.17 17.22 57.94 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.787 -177.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -91.92 144.56 25.34 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.464 HG22 ' O ' ' A' ' 19' ' ' GLU . 0.5 OUTLIER -88.15 156.24 3.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.349 0.595 . . . . 0.0 110.81 -178.764 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.436 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.5 p90 -162.21 160.61 27.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.096 177.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.782 ' HE1' HE21 ' A' ' 18' ' ' GLN . 13.8 m-85 -116.82 135.28 53.86 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.219 -176.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.653 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -131.4 124.09 54.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 120.904 0.383 . . . . 0.0 110.825 179.704 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.536 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 1.4 t0 -76.78 131.64 38.82 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 170.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.4 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 70.8 m-70 -97.9 -0.75 44.37 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 121.003 -0.279 . . . . 0.0 111.651 -172.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.414 HD13 ' CA ' ' A' ' 15' ' ' GLY . 4.8 mt -92.58 -55.29 6.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.896 177.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -95.53 -14.96 23.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.748 0.308 . . . . 0.0 110.18 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.536 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 2.0 mmtt 70.58 71.76 0.2 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.98 176.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.571 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.6 mtp180 -122.38 119.12 30.1 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.24 174.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.612 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -104.01 114.09 28.09 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.469 178.833 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.31 138.59 53.08 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.666 0.269 . . . . 0.0 111.134 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -78.42 -14.65 59.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.848 0.356 . . . . 0.0 110.857 175.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.463 ' HB3' ' HE1' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -102.86 155.57 18.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.497 -178.386 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.498 ' OD2' ' HG ' ' A' ' 43' ' ' LEU . 5.2 t0 -73.02 121.87 86.21 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.199 -175.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.486 ' HA ' ' HB2' ' A' ' 45' ' ' PHE . 17.0 Cg_exo -67.77 -8.93 23.91 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 123.327 2.685 . . . . 0.0 112.817 -179.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.625 ' HA ' HH11 ' A' ' 42' ' ' ARG . 0.0 OUTLIER -90.82 -11.27 39.88 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.909 178.594 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.498 ' HG ' ' OD2' ' A' ' 40' ' ' ASP . 67.1 mt -82.61 -91.16 0.07 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.706 0.288 . . . . 0.0 111.466 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -105.55 13.23 30.32 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -173.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.486 ' HB2' ' HA ' ' A' ' 41' ' ' PRO . 43.7 m-85 -94.42 24.52 4.45 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.308 0.575 . . . . 0.0 110.599 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -46.64 72.29 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.581 176.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.456 ' H ' HG22 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -110.59 140.68 28.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.202 179.039 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -73.0 90.96 1.52 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.798 177.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.6 t70 59.3 -113.22 0.64 Allowed 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.737 -175.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -164.79 125.81 1.4 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-O 120.583 0.23 . . . . 0.0 110.679 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -73.34 -13.32 25.43 Favored 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 122.786 2.324 . . . . 0.0 112.453 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.5 m -81.21 72.69 8.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.19 0.519 . . . . 0.0 110.522 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.8 mtmt -160.5 154.69 19.67 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.407 179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo . . . . . 0 C--O 1.25 1.075 0 C-N-CA 122.492 2.128 . . . . 0.0 111.994 176.466 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 34.6 mt . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.684 0.278 . . . . 0.0 111.353 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.473 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 23.6 Cg_exo -65.61 159.38 48.44 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.87 2.38 . . . . 0.0 111.396 173.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.5 137.23 36.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 121.125 0.488 . . . . 0.0 110.128 171.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.56 -43.06 1.76 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.484 -175.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.473 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 95.2 m95 -75.94 132.87 40.52 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.943 0.719 . . . . 0.0 112.943 -175.306 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -114.09 142.87 45.66 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.722 174.021 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -97.4 117.1 30.89 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.3 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -127.41 174.54 8.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.087 0.47 . . . . 0.0 110.478 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -132.29 140.33 48.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.082 176.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.488 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -87.84 -173.81 4.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.074 0.464 . . . . 0.0 111.068 -178.501 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.542 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -73.56 -20.89 60.51 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.593 -176.885 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.488 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 44.0 m-80 -85.95 -6.4 59.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.098 0.475 . . . . 0.0 110.395 179.142 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.25 12.82 78.19 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.757 -178.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.49 124.59 32.98 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.072 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.9 p -73.6 145.63 11.33 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 120.048 -0.661 . . . . 0.0 110.381 178.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -148.31 159.35 44.08 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.263 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -120.51 137.77 54.19 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.091 -175.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.632 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.13 118.61 37.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-O 121.38 0.609 . . . . 0.0 110.701 -178.302 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.598 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -76.27 138.71 40.73 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.948 176.0 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -109.38 23.5 14.38 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.045 0.45 . . . . 0.0 111.176 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.8 mm -103.07 -53.8 7.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.483 175.379 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.9 -22.3 15.86 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.263 175.228 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.598 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 1.0 OUTLIER 77.11 62.64 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.907 172.925 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.485 ' HG3' ' OD2' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -122.49 123.58 41.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.929 0.395 . . . . 0.0 111.311 174.936 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.632 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -87.42 119.72 27.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.108 175.015 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.438 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 6.3 t -123.76 136.68 54.57 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.15 0.5 . . . . 0.0 110.422 178.543 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -89.77 11.9 18.7 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.823 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.503 HD22 ' HA ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -122.0 156.92 32.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.445 179.129 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.3 t70 . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.925 -177.829 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.468 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 4.2 mt . . . . . 0 C--O 1.235 0.297 0 CA-C-O 120.441 0.162 . . . . 0.0 110.89 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.56 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.5 Cg_exo -57.53 163.09 9.17 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.309 2.006 . . . . 0.0 111.546 170.426 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.81 -34.06 71.08 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.414 -172.173 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -75.91 -23.74 71.28 Favored Glycine 0 CA--C 1.518 0.222 0 C-N-CA 121.083 -0.579 . . . . 0.0 113.278 -178.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.56 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 85.4 m95 -86.14 147.36 26.18 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.464 0.649 . . . . 0.0 112.654 -175.634 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.421 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 4.2 mm-40 -125.13 138.65 54.16 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.561 173.084 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -91.29 95.3 9.95 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.629 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.4 mm-40 -104.9 166.68 10.22 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.025 -175.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.0 m -124.72 137.65 54.33 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.565 176.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.91 -178.31 6.79 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.392 0.615 . . . . 0.0 110.814 -179.014 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.508 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -69.23 -29.02 66.86 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.753 -176.7 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -75.02 -33.17 61.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.237 0.542 . . . . 0.0 109.738 178.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 113.6 21.25 5.83 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.934 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -96.5 131.95 42.57 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 174.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -78.63 151.13 5.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.504 0.668 . . . . 0.0 110.349 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.4 p90 -154.56 161.2 41.74 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.289 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.443 ' CD1' HD11 ' A' ' 12' ' ' LEU . 14.1 m-85 -116.58 131.69 56.88 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.281 -176.021 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.718 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -128.94 123.8 59.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.278 0.561 . . . . 0.0 110.917 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -72.91 119.71 17.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 171.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.421 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 38.3 m-70 -89.51 0.73 56.68 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.276 0.56 . . . . 0.0 111.295 -174.555 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 12.3 mt -105.34 -52.53 7.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.871 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.472 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 71.0 m-80 -89.09 6.29 40.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.937 -178.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 33' ' ' ASN . 0.0 OUTLIER 42.27 53.9 4.35 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.607 1.163 . . . . 0.0 113.61 177.695 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.546 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 8.7 mtp180 -116.01 124.07 49.57 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 122.182 -0.324 . . . . 0.0 110.322 176.092 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.718 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.96 112.82 26.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.405 177.989 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.436 HG22 ' CZ3' ' A' ' 16' ' ' TRP . 12.4 t -126.21 139.71 53.13 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 120.877 0.37 . . . . 0.0 110.827 -179.318 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -91.2 5.42 49.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.87 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.612 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -121.08 165.87 14.71 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.883 178.418 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.612 ' H ' HD13 ' A' ' 39' ' ' LEU . 32.8 t0 . . . . . 0 C--N 1.327 -0.399 0 O-C-N 123.4 0.438 . . . . 0.0 110.491 -178.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.659 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 0.1 OUTLIER . . . . . 0 CA--C 1.515 -0.381 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.583 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 32.4 Cg_exo -57.24 167.46 3.44 Favored 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.315 2.01 . . . . 0.0 111.187 169.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -55.94 -37.48 69.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.057 -174.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -78.42 -23.73 64.69 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.647 -0.787 . . . . 0.0 113.113 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.659 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 92.6 m95 -87.9 144.58 26.49 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -173.656 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.44 ' HB2' ' HD2' ' A' ' 31' ' ' HIS . 1.8 mm-40 -130.26 146.48 51.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.664 176.455 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -97.43 104.38 16.39 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.985 0.422 . . . . 0.0 110.432 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.638 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.2 mt-10 -114.18 165.23 12.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.017 -178.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.43 145.37 44.18 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.933 0.397 . . . . 0.0 110.567 177.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.403 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -81.04 -177.93 6.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.975 0.416 . . . . 0.0 110.353 179.158 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.405 ' HG3' ' H ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -65.68 -28.16 68.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.668 -175.929 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.403 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 3.9 m-80 -85.18 -46.12 11.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.159 0.504 . . . . 0.0 110.737 -178.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.69 12.15 0.8 Allowed Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.899 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.48 133.67 34.46 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 175.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.5 p -86.16 153.93 3.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.428 0.632 . . . . 0.0 110.983 -178.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.638 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 54.4 p90 -155.29 163.0 40.73 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.834 -1.075 . . . . 0.0 109.263 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.608 ' CD1' HD21 ' A' ' 12' ' ' LEU . 11.4 m-85 -118.92 137.87 53.17 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.826 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.531 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -130.75 125.06 57.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 121.162 0.505 . . . . 0.0 111.269 -178.047 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.422 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 54.2 t0 -76.68 99.26 5.0 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 173.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.44 ' HD2' ' HB2' ' A' ' 17' ' ' GLU . 30.8 m-70 -75.82 -7.43 54.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.698 0.285 . . . . 0.0 111.193 -172.107 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 46.6 mm -63.29 -48.94 85.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.124 0.488 . . . . 0.0 110.317 176.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.69 2.47 14.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.598 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.496 ' N ' ' HE3' ' A' ' 34' ' ' LYS . 0.0 OUTLIER 60.61 62.99 1.4 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.588 176.307 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.422 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -122.84 125.34 45.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.753 0.311 . . . . 0.0 110.376 173.486 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.451 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -97.7 120.56 38.3 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.944 -178.707 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.561 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 12.8 t -126.37 139.28 53.4 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.152 0.501 . . . . 0.0 110.441 176.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -85.63 -12.05 52.37 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.368 0.604 . . . . 0.0 110.027 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.474 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -83.53 149.67 26.46 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.348 179.442 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.474 ' H ' HD13 ' A' ' 39' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.437 -1.089 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.166 -176.011 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.0 mt . . . . . 0 C--O 1.234 0.272 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.456 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.0 Cg_exo -58.82 174.67 0.77 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.455 2.77 . . . . 0.0 112.319 170.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -64.77 -41.09 96.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.403 -175.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.34 -25.25 75.64 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.882 -0.675 . . . . 0.0 113.256 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.456 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 92.1 m95 -87.57 142.94 27.46 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.412 0.625 . . . . 0.0 112.601 -175.185 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.37 154.06 34.19 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.063 174.682 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -105.23 101.88 11.4 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.632 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.3 mm-40 -113.17 165.52 12.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.678 -175.504 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.7 m -116.45 138.25 51.52 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.794 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.78 178.6 7.24 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 121.343 0.592 . . . . 0.0 110.506 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.512 ' HG2' ' H ' ' A' ' 22' ' ' GLU . 0.5 OUTLIER -59.68 -39.58 84.98 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.125 -177.239 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -73.08 -49.59 27.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.778 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 139.42 10.88 0.79 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.974 -0.631 . . . . 0.0 112.033 -178.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -85.66 143.17 28.56 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.4 p -86.35 156.7 3.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.233 0.539 . . . . 0.0 111.052 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.506 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 45.9 p90 -158.85 161.91 36.91 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.608 178.236 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -116.97 132.52 56.68 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.442 -176.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.632 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -130.02 130.0 65.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.836 179.017 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.49 132.4 36.32 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 172.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.0 m-70 -100.77 15.76 27.27 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.251 -0.58 . . . . 0.0 111.666 -173.079 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.2 mt -99.01 -54.27 7.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.078 173.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.443 ' O ' ' HB2' ' A' ' 34' ' ' LYS . 3.5 m120 -95.15 -15.97 22.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.249 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 33' ' ' ASN . 0.4 OUTLIER 74.31 39.49 0.47 Allowed 'General case' 0 N--CA 1.464 0.271 0 O-C-N 124.191 0.932 . . . . 0.0 111.529 177.796 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.503 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 58.5 mtp180 -89.8 136.01 33.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.86 0.362 . . . . 0.0 110.538 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -115.89 118.06 31.93 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.377 -178.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.427 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 2.3 t -125.46 131.94 52.78 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.004 0.431 . . . . 0.0 110.263 176.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -88.91 0.08 56.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.46 0.647 . . . . 0.0 109.926 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.92 163.45 15.54 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.031 176.465 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.3 t0 . . . . . 0 C--N 1.324 -0.542 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.715 -178.236 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 120.505 0.193 . . . . 0.0 111.318 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.525 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 72.4 Cg_exo -52.53 168.62 0.42 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.137 2.558 . . . . 0.0 112.033 168.481 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -64.89 -38.36 90.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.165 -173.468 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.73 -27.04 71.48 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.056 -0.593 . . . . 0.0 113.05 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.525 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 94.2 m95 -85.21 141.94 29.79 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -176.4 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -124.29 138.75 54.36 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.92 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -88.08 100.6 13.06 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.265 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -100.96 172.23 7.15 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.506 -178.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 m -134.25 134.69 42.27 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.33 174.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.6 -174.28 5.19 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.527 -175.352 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.429 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -70.58 -31.58 68.64 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.311 -177.44 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -76.17 -25.65 55.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.36 0.6 . . . . 0.0 109.903 178.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 105.95 12.07 26.75 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.769 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.97 144.19 30.16 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 174.802 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.1 p -86.94 153.87 3.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-O 121.145 0.498 . . . . 0.0 110.25 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -159.41 156.69 28.87 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.171 178.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -113.18 132.72 55.37 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.012 -175.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.645 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -125.41 123.54 65.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-O 121.474 0.654 . . . . 0.0 111.169 -179.145 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.622 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 12.1 t0 -77.38 133.57 38.66 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.528 172.505 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.4 m-70 -100.84 -2.84 31.11 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 120.711 0.291 . . . . 0.0 111.271 -174.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.2 mt -88.09 -61.72 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 120.899 0.381 . . . . 0.0 110.304 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.524 ' C ' ' HG2' ' A' ' 34' ' ' LYS . 3.1 p30 -106.91 23.25 14.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.102 0.477 . . . . 0.0 110.615 178.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.622 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.0 OUTLIER 38.1 75.38 0.07 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.799 1.24 . . . . 0.0 113.894 173.499 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.477 ' HD3' ' CH2' ' A' ' 16' ' ' TRP . 0.0 OUTLIER -122.23 119.41 31.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.715 0.293 . . . . 0.0 110.401 172.944 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.645 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -99.83 113.99 26.87 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.195 178.01 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.7 t -126.33 132.87 51.52 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.391 0.139 . . . . 0.0 110.735 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -76.6 -26.89 55.48 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.212 0.53 . . . . 0.0 110.306 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.26 168.82 8.93 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.357 -178.422 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 13.5 t70 . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.052 -176.901 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.59 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 42.9 Cg_exo -56.53 158.11 16.9 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 121.874 1.716 . . . . 0.0 110.911 169.382 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -36.73 70.01 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.101 -0.499 . . . . 0.0 112.072 -171.081 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.32 -30.37 75.3 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.877 -0.677 . . . . 0.0 113.249 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.638 ' HZ3' HG22 ' A' ' 37' ' ' THR . 86.6 m95 -81.39 130.38 35.02 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -173.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.426 ' OE1' ' HA ' ' A' ' 17' ' ' GLU . 4.9 mm-40 -114.25 150.98 33.55 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.015 174.45 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -96.7 104.62 16.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.821 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.611 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 0.8 OUTLIER -115.63 166.2 12.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.137 0.494 . . . . 0.0 110.64 -176.94 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.03 139.89 53.4 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.587 174.697 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.453 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -81.3 -179.07 7.2 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.382 0.61 . . . . 0.0 110.713 -179.273 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.33 -11.51 60.73 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.013 -173.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.453 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 29.5 m-80 -101.81 -6.32 23.75 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.056 0.455 . . . . 0.0 110.252 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 91.12 16.11 54.56 Favored Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.969 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -89.46 125.45 35.18 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 175.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 6.0 p -75.89 150.96 6.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.471 0.653 . . . . 0.0 110.992 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 41.1 p90 -156.17 158.53 37.79 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.541 -1.208 . . . . 0.0 108.76 176.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -119.01 136.59 54.04 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.507 -176.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.633 ' HA ' ' O ' ' A' ' 35' ' ' ARG . 0.2 OUTLIER -133.27 124.28 48.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.482 0.658 . . . . 0.0 111.979 -176.509 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.451 ' HB2' ' CE2' ' A' ' 16' ' ' TRP . 50.4 t0 -74.05 109.58 7.66 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.308 171.144 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 43.2 m-70 -82.52 -1.54 50.81 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.07 0.462 . . . . 0.0 111.101 -175.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.8 mm -97.03 -52.94 8.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.835 176.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -90.7 -5.42 55.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.159 -178.048 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 62.15 61.29 1.35 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.455 176.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.633 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -123.8 118.94 28.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.688 177.102 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.526 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.01 109.41 21.4 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.483 176.433 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.638 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 8.8 t -123.85 136.76 54.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.189 0.519 . . . . 0.0 110.72 -178.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -83.71 5.2 25.52 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.257 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.44 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -112.32 152.89 28.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.77 0.319 . . . . 0.0 110.639 179.05 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.44 ' H ' HD13 ' A' ' 39' ' ' LEU . 17.4 t0 . . . . . 0 C--N 1.325 -0.489 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.343 -174.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.497 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 49.3 mt . . . . . 0 N--CA 1.446 -0.643 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.588 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 49.9 Cg_exo -56.29 163.53 6.32 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 121.759 1.639 . . . . 0.0 110.925 174.394 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -55.6 -38.3 69.25 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.949 -170.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -76.29 -25.32 66.28 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.147 -0.549 . . . . 0.0 114.323 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.588 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 88.5 m95 -83.99 143.55 29.72 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -172.832 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.425 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -121.15 149.54 42.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.634 173.595 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -98.82 103.09 15.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.107 0.479 . . . . 0.0 109.769 179.082 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -105.31 167.22 9.88 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.143 -177.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.9 m -134.57 138.8 44.89 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.077 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.483 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -78.18 172.29 13.78 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 121.349 0.595 . . . . 0.0 109.47 178.185 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -72.47 -10.37 59.7 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.771 -172.029 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.483 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 35.5 m-80 -100.05 -1.59 36.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.265 0.555 . . . . 0.0 110.004 178.079 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 90.55 15.45 56.85 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.564 -0.744 . . . . 0.0 113.252 176.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -88.2 120.9 30.0 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 173.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -74.68 154.01 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.389 0.614 . . . . 0.0 110.829 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -160.75 155.26 23.51 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.293 176.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -113.12 136.98 52.12 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.951 -175.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.734 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.74 122.35 49.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.242 0.544 . . . . 0.0 111.087 -177.816 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.495 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -76.0 128.16 34.47 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 172.942 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.425 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 67.4 m-70 -99.05 15.07 27.03 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.806 0.336 . . . . 0.0 111.317 -175.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 21.9 mm -91.49 -55.52 6.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.085 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -120.64 3.01 10.69 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.5 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.0 OUTLIER 73.61 79.42 0.13 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.454 -0.793 . . . . 0.0 112.611 170.199 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.669 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -122.77 118.27 27.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.293 173.988 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.734 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.78 114.71 29.02 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.172 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.435 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 2.2 t -126.25 134.13 51.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.658 0.266 . . . . 0.0 110.772 -179.145 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -79.26 -17.83 53.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.142 0.496 . . . . 0.0 110.971 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.4 159.34 16.22 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.589 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.3 t70 . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.753 -176.742 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.553 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 84.2 mt . . . . . 0 N--CA 1.449 -0.508 0 N-CA-C 110.394 -0.225 . . . . 0.0 110.394 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.579 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 36.5 Cg_exo -63.63 177.4 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.393 2.062 . . . . 0.0 112.465 173.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -58.39 -39.05 78.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.766 -171.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -90.99 -15.64 55.81 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.56 -0.829 . . . . 0.0 113.909 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.581 ' HZ3' HG22 ' A' ' 37' ' ' THR . 85.3 m95 -89.22 139.47 30.45 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -171.045 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -120.36 132.13 55.14 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.853 174.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -80.84 104.48 11.38 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 176.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.564 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.0 OUTLIER -114.93 164.5 14.05 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.371 -178.422 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 18.2 m -129.27 138.81 51.85 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.4 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.18 178.71 3.7 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.504 0.668 . . . . 0.0 110.946 -177.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.427 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -68.15 -19.94 64.85 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.864 -173.307 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -93.06 -43.81 8.7 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.443 -178.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 139.05 18.5 0.51 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.665 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.509 ' HB3' ' HE2' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -90.63 126.96 36.13 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 175.462 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -79.79 153.83 4.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 120.283 -0.567 . . . . 0.0 110.743 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.7 p90 -162.97 158.72 22.63 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.843 178.303 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -116.94 138.08 51.79 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.514 -177.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.619 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.8 124.35 53.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.364 0.602 . . . . 0.0 111.411 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -74.31 107.76 6.67 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 170.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -82.52 1.19 39.03 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.159 0.504 . . . . 0.0 111.117 -174.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.3 mm -97.73 -55.38 6.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.351 0.596 . . . . 0.0 109.623 176.163 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -92.56 -1.12 57.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.379 -176.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm 59.6 61.51 1.96 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.692 175.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.588 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -124.07 117.78 25.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.611 175.647 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.619 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -103.72 114.11 28.12 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.289 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.581 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 3.3 t -125.54 132.42 52.59 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.976 0.417 . . . . 0.0 110.746 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.509 ' HE2' ' HB3' ' A' ' 25' ' ' GLN . 26.0 m-85 -83.75 -4.91 59.01 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.764 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.583 HD12 ' H ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -115.54 172.08 7.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.436 175.942 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.583 ' H ' HD12 ' A' ' 39' ' ' LEU . 10.1 t70 . . . . . 0 C--N 1.325 -0.5 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.282 -174.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.666 HD11 ' HD1' ' A' ' 28' ' ' PHE . 43.9 mt . . . . . 0 N--CA 1.456 -0.175 0 CA-C-O 120.725 0.298 . . . . 0.0 111.436 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.519 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 50.7 Cg_exo -59.39 173.9 1.27 Allowed 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 123.366 2.711 . . . . 0.0 112.348 170.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.4 -41.72 94.46 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.034 -175.088 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -74.48 -28.89 62.68 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.613 -177.12 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.544 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 91.6 m95 -83.84 134.53 34.7 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.252 0.549 . . . . 0.0 112.394 -173.636 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -119.35 143.09 47.59 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.563 174.134 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -94.34 106.76 18.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.922 0.391 . . . . 0.0 109.997 -177.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.572 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.5 mt-10 -114.85 167.8 10.46 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.373 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.2 m -124.29 136.63 54.27 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.173 175.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.1 177.32 9.03 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.099 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -64.92 -35.01 79.77 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.245 -176.235 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -67.05 -37.72 84.54 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.301 0.572 . . . . 0.0 109.82 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 116.6 15.96 6.68 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.343 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -87.69 137.69 32.12 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 173.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.9 p -84.26 145.5 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 120.015 -0.674 . . . . 0.0 109.938 178.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.533 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.2 p90 -147.18 155.49 42.16 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.502 -179.392 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.666 ' HD1' HD11 ' A' ' 12' ' ' LEU . 17.9 m-85 -114.35 132.17 56.29 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.872 -174.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.572 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -131.07 120.3 46.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-O 121.142 0.496 . . . . 0.0 110.85 -179.122 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.502 ' HB3' ' HD3' ' A' ' 35' ' ' ARG . 4.6 t0 -78.7 112.68 16.06 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 171.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.6 m-70 -82.82 -10.15 58.99 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.043 -172.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.0 mm -75.32 -56.54 8.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.943 ' HB2' ' HD2' ' A' ' 35' ' ' ARG . 61.9 m-80 -93.57 -5.08 49.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.599 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.5 mmtm 62.82 61.69 1.13 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.832 176.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.943 ' HD2' ' HB2' ' A' ' 33' ' ' ASN . 0.8 OUTLIER -122.74 123.34 40.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.56 176.3 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.56 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -105.23 117.41 33.93 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.692 179.809 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.537 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 1.8 t -125.49 130.97 52.84 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.892 0.377 . . . . 0.0 110.247 177.305 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.519 ' HA ' ' CB ' ' A' ' 27' ' ' PHE . 11.2 m-85 -78.53 -17.25 56.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.023 -177.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -112.88 166.47 11.36 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 120.87 0.366 . . . . 0.0 111.009 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.7 t0 . . . . . 0 C--N 1.324 -0.501 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.695 -177.281 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.496 HD11 ' CD1' ' A' ' 28' ' ' PHE . 17.1 mt . . . . . 0 N--CA 1.452 -0.366 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.501 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 76.8 Cg_exo -55.21 177.86 0.1 Allowed 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.6 2.867 . . . . 0.0 112.885 172.631 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -65.07 -43.12 93.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.54 -176.081 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.37 -28.94 72.02 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.249 -0.501 . . . . 0.0 112.613 -176.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.515 ' HZ3' HG22 ' A' ' 37' ' ' THR . 92.8 m95 -83.74 146.91 27.93 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -129.32 138.54 51.64 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.321 175.09 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -93.13 101.18 13.47 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.595 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 2.0 mt-10 -106.1 164.06 12.29 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.053 -178.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 12.7 m -125.65 134.28 51.92 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.018 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.419 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -73.67 172.94 10.5 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 121.269 0.556 . . . . 0.0 110.053 179.021 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.442 ' HG3' ' H ' ' A' ' 22' ' ' GLU . 0.3 OUTLIER -65.93 -27.14 67.95 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.484 -173.945 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.419 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 40.3 m-80 -76.98 -36.89 56.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.311 0.577 . . . . 0.0 109.68 177.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 126.79 7.6 5.07 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.891 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -78.02 116.43 18.5 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 176.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.2 p -74.14 154.76 6.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-O 121.176 0.513 . . . . 0.0 110.209 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.537 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 51.9 p90 -164.74 159.76 19.02 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.542 -0.753 . . . . 0.0 110.416 -177.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.496 ' CD1' HD11 ' A' ' 12' ' ' LEU . 6.9 m-85 -114.39 130.66 56.71 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.71 -176.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.595 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -130.93 127.57 61.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 121.174 0.512 . . . . 0.0 110.08 176.816 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.667 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -75.38 136.17 40.78 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 173.762 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.4 m-70 -107.63 28.67 7.94 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.26 0.553 . . . . 0.0 111.429 -176.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.3 mm -107.95 -54.91 5.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 171.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.49 ' O ' ' HB2' ' A' ' 34' ' ' LYS . 59.3 m-80 -95.13 -28.51 15.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.835 177.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.667 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.1 OUTLIER 79.49 53.21 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.237 174.12 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.38 131.76 54.77 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.448 174.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.55 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -96.5 125.81 41.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.852 -178.271 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.515 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 2.7 t -125.77 138.17 53.84 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.928 0.394 . . . . 0.0 110.104 175.177 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -89.16 -8.18 54.19 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.531 178.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.452 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -112.51 157.51 21.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.39 179.186 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.452 ' H ' HD13 ' A' ' 39' ' ' LEU . 12.2 t70 . . . . . 0 C--N 1.325 -0.496 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.6 -177.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.533 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 24.3 mt . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.926 0.393 . . . . 0.0 111.474 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.535 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 32.6 Cg_exo -61.27 169.87 5.85 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.167 2.578 . . . . 0.0 112.515 174.456 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.59 -40.03 62.23 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.335 -0.848 . . . . 0.0 113.169 -173.493 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -83.33 -12.3 78.93 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.39 -0.909 . . . . 0.0 113.68 -175.273 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.615 ' HZ3' HG22 ' A' ' 37' ' ' THR . 87.6 m95 -92.27 137.97 31.92 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -172.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -120.45 141.69 49.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.542 174.249 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -92.84 104.2 16.48 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.552 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.7 mt-10 -114.67 168.63 9.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.648 -176.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.24 140.57 51.86 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.205 176.378 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.468 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -77.53 -176.56 4.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.191 0.52 . . . . 0.0 110.349 179.846 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.7 -26.37 66.14 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.427 -176.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.468 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 16.6 m-80 -84.44 -43.16 14.91 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.083 0.468 . . . . 0.0 110.842 -178.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 131.2 16.5 1.54 Allowed Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.906 -0.664 . . . . 0.0 111.854 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.0 126.96 35.64 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 174.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -80.05 152.1 4.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.352 0.596 . . . . 0.0 110.849 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.552 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 54.1 p90 -157.63 166.03 33.94 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.704 -178.092 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -118.34 134.96 54.61 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.703 -179.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.549 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -129.45 124.94 60.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-O 121.138 0.494 . . . . 0.0 111.0 -179.828 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.611 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 2.6 t0 -73.56 114.06 11.38 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 171.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -86.99 0.27 55.45 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.749 -0.38 . . . . 0.0 112.012 -172.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -79.42 -49.51 19.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -101.16 -11.39 19.59 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.279 -178.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.67 58.98 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.181 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.611 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -122.29 125.68 46.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.689 179.27 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -96.93 129.35 44.39 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.001 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.615 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 7.1 t -125.51 132.22 52.67 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 172.263 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -93.02 0.05 57.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.453 0.644 . . . . 0.0 109.998 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -116.65 159.53 22.06 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.26 173.44 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.1 t70 . . . . . 0 C--N 1.319 -0.731 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.653 -174.814 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.403 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 7.9 mt . . . . . 0 N--CA 1.45 -0.469 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.55 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.9 Cg_exo -56.17 173.26 0.46 Allowed 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.844 2.362 . . . . 0.0 112.251 172.115 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -61.46 -39.38 90.66 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.837 -173.131 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -75.92 -24.7 68.7 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.919 -0.657 . . . . 0.0 114.062 -175.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.55 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 88.2 m95 -82.42 138.2 34.49 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -171.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.445 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -118.19 153.56 33.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.834 175.369 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -107.79 106.63 17.01 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.468 178.432 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.513 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.1 mt-10 -110.78 178.55 4.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.436 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.19 138.13 53.62 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.477 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.525 ' OD1' ' HG3' ' A' ' 22' ' ' GLU . 0.8 OUTLIER -107.86 179.24 4.28 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 -179.056 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.525 ' HG3' ' OD1' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -26.4 -78.6 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -166.767 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -88.35 35.44 0.76 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.166 0.507 . . . . 0.0 111.915 -170.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.51 4.84 89.97 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.888 -0.672 . . . . 0.0 111.486 178.164 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -61.14 113.93 2.85 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.36 -0.42 . . . . 0.0 109.917 177.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.3 p -78.7 153.25 4.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.201 0.524 . . . . 0.0 110.752 -179.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.513 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 53.9 p90 -157.94 161.18 38.19 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.906 177.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.403 ' HA ' ' O ' ' A' ' 17' ' ' GLU . 15.2 m-85 -116.97 137.13 52.42 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.089 -175.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.511 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.2 OUTLIER -129.54 121.03 52.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.342 0.591 . . . . 0.0 111.344 -178.652 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.717 ' HB3' ' HG2' ' A' ' 35' ' ' ARG . 43.0 t0 -78.31 117.22 19.34 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.722 -1.127 . . . . 0.0 108.958 177.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.445 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 73.7 m-70 -89.39 -4.07 58.19 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.815 0.34 . . . . 0.0 111.17 -176.313 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 17.7 mm -95.79 -42.79 12.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.195 0.521 . . . . 0.0 110.048 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.525 ' CB ' ' HD3' ' A' ' 35' ' ' ARG . 69.5 m-80 -98.13 -7.43 29.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.002 -179.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.01 51.59 2.8 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.404 173.587 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.717 ' HG2' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -125.9 142.3 51.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.679 0.276 . . . . 0.0 111.472 177.026 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.511 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -111.15 119.17 38.07 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.262 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.548 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 15.3 t -125.25 137.7 54.1 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.056 0.455 . . . . 0.0 110.891 178.576 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -91.65 3.81 54.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.898 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.92 163.92 16.84 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.832 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.7 t70 . . . . . 0 C--N 1.323 -0.568 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.567 -177.806 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.789 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--O 1.235 0.304 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.451 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 47.4 Cg_exo -60.6 -168.73 0.05 OUTLIER 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.826 3.017 . . . . 0.0 112.475 169.376 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.45 -45.32 72.83 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.011 -174.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -82.02 -21.96 60.19 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.64 -0.791 . . . . 0.0 113.157 -175.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.789 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 85.6 m95 -83.28 144.89 29.42 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -171.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.416 ' HB2' ' HD2' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -124.73 146.83 48.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.115 174.185 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.503 ' HB2' ' CD2' ' A' ' 12' ' ' LEU . 5.9 tt0 -100.6 100.96 11.75 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.618 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 5.0 mt-10 -108.91 168.17 9.55 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.102 0.477 . . . . 0.0 110.99 -175.455 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -114.28 137.62 51.56 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.549 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -176.14 4.92 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.097 0.475 . . . . 0.0 110.677 -179.171 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -70.45 -30.0 66.72 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.248 -175.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -78.34 -43.77 26.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.185 0.517 . . . . 0.0 109.764 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 128.74 25.78 0.99 Allowed Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.998 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.7 149.36 23.4 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 174.061 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.49 156.07 3.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.35 0.595 . . . . 0.0 110.653 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 46.0 p90 -161.05 163.72 31.37 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.592 178.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.689 ' CD1' HD21 ' A' ' 12' ' ' LEU . 14.3 m-85 -117.2 131.42 56.87 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.484 -176.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.642 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.46 122.04 46.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.329 0.585 . . . . 0.0 110.791 179.519 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.549 ' HA ' ' HA ' ' A' ' 16' ' ' TRP . 0.0 OUTLIER -77.83 126.62 31.12 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 172.949 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.416 ' HD2' ' HB2' ' A' ' 17' ' ' GLU . 64.5 m-70 -99.56 9.5 43.08 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.39 -174.095 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.5 mm -94.2 -49.34 12.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.093 0.473 . . . . 0.0 109.891 175.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -108.96 -1.52 18.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.648 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm 64.72 65.41 0.62 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 170.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.588 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -123.72 134.12 53.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.565 0.222 . . . . 0.0 111.094 173.856 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.642 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -112.1 118.75 36.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.664 179.413 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.499 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 1.8 t -125.98 136.84 53.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.775 0.321 . . . . 0.0 110.517 176.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -87.28 -7.23 58.08 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.062 0.458 . . . . 0.0 110.659 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.43 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -113.8 164.42 13.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.759 176.249 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.414 ' H ' HD13 ' A' ' 39' ' ' LEU . 9.7 t70 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.858 -176.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.474 HD11 ' HB2' ' A' ' 18' ' ' GLN . 14.5 mt . . . . . 0 N--CA 1.427 -1.596 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.535 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 26.9 Cg_exo -63.15 168.26 11.16 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.479 2.119 . . . . 0.0 112.065 178.682 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.53 -39.45 80.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.688 -174.72 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -80.22 -20.79 66.39 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.553 -0.832 . . . . 0.0 113.047 -176.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.535 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 79.8 m95 -86.24 138.95 31.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.402 0.62 . . . . 0.0 112.36 -176.362 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -122.8 143.59 49.74 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.011 175.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.474 ' HB2' HD11 ' A' ' 12' ' ' LEU . 7.5 tt0 -93.42 110.55 22.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.074 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.657 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 2.3 mt-10 -119.92 165.28 14.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.515 -178.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.3 m -121.61 133.89 55.0 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.573 177.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.77 -177.8 6.81 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.255 0.55 . . . . 0.0 111.075 -176.633 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.97 -18.06 62.02 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.931 -174.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -88.5 -8.36 54.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.339 0.59 . . . . 0.0 109.563 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.1 19.05 58.24 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.06 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -97.44 135.63 39.03 Favored 'General case' 0 N--CA 1.438 -1.038 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 176.194 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.0 p -78.47 151.01 5.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.717 0.77 . . . . 0.0 111.084 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.657 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 50.8 p90 -150.84 160.85 43.61 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.135 177.363 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -116.55 137.93 51.8 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.571 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.53 126.52 55.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 CA-C-O 121.294 0.568 . . . . 0.0 111.492 -179.079 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.561 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 4.8 t70 -77.33 123.61 26.73 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.914 -1.039 . . . . 0.0 108.46 172.665 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 73.1 m-70 -98.73 9.11 44.06 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.322 -175.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 13.6 mm -91.27 -57.03 4.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.911 178.036 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.61 1.5 19.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.177 178.403 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 12.2 mptt 67.03 72.47 0.36 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.317 -0.856 . . . . 0.0 113.084 168.381 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.2 OUTLIER -123.84 120.31 32.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.573 172.172 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.571 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -97.57 117.1 31.07 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.235 176.309 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.524 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 2.7 t -125.63 131.9 52.58 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.856 0.36 . . . . 0.0 110.761 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -79.87 -15.7 56.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.373 0.606 . . . . 0.0 109.699 178.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.47 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER -102.52 161.5 13.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.834 -178.992 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.47 ' H ' HD13 ' A' ' 39' ' ' LEU . 55.5 t0 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.349 -175.114 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.407 HD11 ' CD1' ' A' ' 28' ' ' PHE . 0.8 OUTLIER . . . . . 0 N--CA 1.452 -0.337 0 CA-C-O 120.674 0.273 . . . . 0.0 111.615 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.502 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 72.9 Cg_exo -54.75 173.65 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 123.17 2.58 . . . . 0.0 112.551 170.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -65.15 -39.84 93.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.196 -174.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.15 -28.82 73.21 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.398 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.544 ' HZ3' HG22 ' A' ' 37' ' ' THR . 89.6 m95 -83.66 122.0 28.03 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.935 0.716 . . . . 0.0 112.935 -174.271 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -101.87 130.51 48.36 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.009 174.131 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -85.01 100.19 11.5 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.039 0.447 . . . . 0.0 110.191 177.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.606 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 2.0 mm-40 -106.91 173.62 6.24 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.732 -176.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 8.0 m -126.39 139.45 53.26 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.241 175.326 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.473 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -83.74 177.51 8.33 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.17 0.51 . . . . 0.0 110.296 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.503 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -70.71 -23.69 62.51 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.368 -174.978 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.473 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 41.1 m-80 -83.96 -11.28 57.08 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.241 0.543 . . . . 0.0 110.39 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 95.48 12.51 53.82 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.473 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -81.57 139.56 35.0 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 174.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -86.45 149.37 4.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.854 176.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.431 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 44.1 p90 -157.54 158.13 35.08 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.095 -0.957 . . . . 0.0 109.984 -179.154 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.407 ' CD1' HD11 ' A' ' 12' ' ' LEU . 10.5 m-85 -114.97 131.98 56.73 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.205 -175.24 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.612 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -129.35 120.53 51.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-O 121.614 0.721 . . . . 0.0 111.113 178.532 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.41 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 38.2 t0 -73.01 120.72 19.03 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.545 173.652 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -93.75 1.38 56.53 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.897 0.38 . . . . 0.0 110.463 -178.058 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.2 mm -101.81 -51.92 8.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.382 0.611 . . . . 0.0 109.632 175.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -89.11 -11.18 44.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.725 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.411 ' HD2' ' HA ' ' A' ' 34' ' ' LYS . 2.6 mmmm 62.64 57.08 1.87 Allowed 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.266 0.626 . . . . 0.0 112.564 175.455 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.57 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -124.57 125.68 44.57 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.303 175.638 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.612 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -102.08 115.64 30.98 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 174.562 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.544 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 1.6 t -126.09 134.44 51.37 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.803 0.335 . . . . 0.0 110.581 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -84.2 -4.38 58.78 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.04 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -121.61 166.7 13.83 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.96 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.7 t0 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.901 -179.951 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 19.9 mt . . . . . 0 N--CA 1.454 -0.261 0 CA-C-O 120.319 0.104 . . . . 0.0 111.025 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.553 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 51.0 Cg_exo -57.28 168.33 2.86 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 122.911 2.408 . . . . 0.0 112.312 174.093 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.86 -39.23 68.41 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.736 -0.665 . . . . 0.0 112.212 -174.161 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -77.98 -22.73 68.08 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.4 -176.156 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.553 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 92.0 m95 -88.41 131.0 35.03 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -173.466 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.415 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 15.7 mm-40 -112.61 140.06 47.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.34 174.306 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -93.27 104.16 16.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.028 0.442 . . . . 0.0 110.164 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.618 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 4.1 mt-10 -109.81 168.45 9.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.713 -177.401 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.8 m -125.63 134.02 52.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.127 175.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.412 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -79.13 -176.51 5.16 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.188 0.518 . . . . 0.0 110.865 -177.56 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.467 ' HG2' ' H ' ' A' ' 22' ' ' GLU . 1.0 OUTLIER -67.42 -32.41 73.27 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.472 -177.42 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.412 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 31.3 m-80 -77.75 -23.58 49.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.265 0.555 . . . . 0.0 110.276 -178.501 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 104.26 14.88 23.09 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.512 -178.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -84.76 137.95 32.9 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 174.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.1 p -84.88 153.96 3.58 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-O 121.476 0.655 . . . . 0.0 110.229 177.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 50.0 p90 -160.19 161.65 33.64 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.47 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.403 ' CD1' HD11 ' A' ' 12' ' ' LEU . 12.5 m-85 -119.38 135.99 54.48 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.388 -176.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.527 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.1 121.97 50.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.691 179.871 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.825 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 7.0 t0 -75.1 118.61 18.24 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 171.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.415 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 28.0 m-70 -87.52 -4.22 58.98 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -171.54 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.4 mt -86.96 -42.79 15.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.947 0.403 . . . . 0.0 110.378 176.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.4 m-80 -101.95 -5.74 24.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.077 179.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.44 58.94 3.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.06 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.825 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 1.3 ptt180 -121.57 121.01 36.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.745 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.527 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -101.78 120.71 40.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.928 -178.813 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.463 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 1.6 t -126.11 137.83 53.63 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.693 0.282 . . . . 0.0 110.486 175.575 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -89.15 -3.83 58.48 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.21 0.528 . . . . 0.0 109.976 177.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.411 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -106.17 156.85 18.03 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.989 175.887 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.411 ' H ' HD13 ' A' ' 39' ' ' LEU . 5.5 t0 . . . . . 0 C--N 1.322 -0.614 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.213 -175.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.508 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 35.3 mt . . . . . 0 N--CA 1.455 -0.204 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.511 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 31.3 Cg_exo -61.09 -172.47 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 123.357 2.704 . . . . 0.0 113.336 176.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -54.56 45.68 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.416 -172.366 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -78.23 -17.26 78.39 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.615 -0.721 . . . . 0.0 113.315 -173.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.575 ' CZ3' HG22 ' A' ' 37' ' ' THR . 92.6 m95 -85.35 133.65 34.13 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.514 0.673 . . . . 0.0 112.735 -170.739 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -120.42 135.9 54.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.578 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -85.12 109.44 18.26 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.616 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.1 mm-40 -118.35 166.99 11.98 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.421 -176.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.8 m -127.69 135.38 50.11 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.87 173.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.73 -178.23 5.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.369 0.604 . . . . 0.0 110.917 -177.173 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -32.08 73.38 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.309 -175.552 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -74.29 -41.66 60.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.436 0.636 . . . . 0.0 110.303 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 125.91 14.05 3.18 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.713 -179.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.39 127.5 34.39 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 175.664 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -79.17 151.69 4.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.348 0.594 . . . . 0.0 110.228 178.597 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.405 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.5 p90 -162.09 160.61 27.57 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.518 -178.063 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.413 ' CD1' HD11 ' A' ' 12' ' ' LEU . 3.2 m-85 -115.25 135.62 53.96 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.828 -179.3 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.616 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -125.68 129.29 72.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.424 0.63 . . . . 0.0 110.981 177.729 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.522 ' HB3' ' CG ' ' A' ' 35' ' ' ARG . 5.2 t0 -77.76 109.76 12.03 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.638 -1.165 . . . . 0.0 108.404 174.312 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -85.35 9.24 16.01 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.457 -174.088 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -94.76 -52.63 9.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.902 0.382 . . . . 0.0 110.082 174.738 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -103.55 -1.43 28.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.233 -178.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.8 mmtp 63.87 61.17 0.98 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.125 0.57 . . . . 0.0 111.981 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.522 ' CG ' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -123.97 135.93 53.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.896 176.886 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -107.13 123.68 48.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.006 -179.322 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.575 HG22 ' CZ3' ' A' ' 16' ' ' TRP . 6.8 t -126.53 135.77 51.72 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.943 0.401 . . . . 0.0 110.512 173.122 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -88.55 -1.52 58.1 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.99 0.424 . . . . 0.0 110.512 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.687 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -122.42 165.64 16.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.142 178.326 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.687 ' H ' HD13 ' A' ' 39' ' ' LEU . 8.3 t70 . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.741 -179.053 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.5 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 16.0 mt . . . . . 0 N--CA 1.448 -0.554 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.54 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 39.6 Cg_exo -59.62 163.37 13.26 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.332 2.021 . . . . 0.0 111.499 169.804 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -56.42 -38.64 71.84 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -173.439 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.7 -23.67 76.65 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 121.123 -0.561 . . . . 0.0 113.421 -178.173 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.571 ' HZ3' HG22 ' A' ' 37' ' ' THR . 87.3 m95 -85.66 129.33 34.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.328 0.585 . . . . 0.0 112.366 -174.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -110.23 139.8 45.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.329 171.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -95.22 107.83 19.94 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.584 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.5 mm-40 -113.47 167.79 10.29 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.932 -174.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.4 m -116.23 140.07 49.69 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 177.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -179.04 7.24 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.026 0.441 . . . . 0.0 110.727 -179.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.459 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -61.74 -32.83 73.1 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.718 -177.36 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -82.53 -43.8 16.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.781 -177.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 136.38 5.81 1.98 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 121.165 -0.541 . . . . 0.0 111.753 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.49 137.8 38.12 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 176.178 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.5 p -88.92 152.2 3.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.419 0.628 . . . . 0.0 110.642 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.519 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 45.5 p90 -154.53 161.92 41.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.79 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -115.64 133.06 56.4 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.862 -176.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.604 ' HA ' ' O ' ' A' ' 35' ' ' ARG . 0.1 OUTLIER -131.42 119.92 44.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.316 0.579 . . . . 0.0 111.234 179.792 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.615 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 5.6 t0 -78.03 110.37 12.91 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 171.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -81.67 -8.12 59.67 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.035 -173.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.6 mm -77.96 -55.96 8.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.249 178.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -99.03 -0.03 42.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.357 -177.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? 68.6 60.46 0.37 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.861 173.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.615 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -122.71 119.79 31.73 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.286 177.902 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.559 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -107.75 112.79 25.64 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.055 177.389 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.571 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 3.4 t -126.24 130.89 51.81 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.064 0.459 . . . . 0.0 110.908 179.436 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -82.34 -10.4 59.1 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.591 179.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.17 162.42 14.96 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.061 178.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.4 t0 . . . . . 0 C--N 1.324 -0.538 0 O-C-N 123.635 0.584 . . . . 0.0 110.94 -176.922 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.451 -0.413 0 N-CA-C 110.415 -0.217 . . . . 0.0 110.415 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.575 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 51.3 Cg_exo -56.8 165.67 4.6 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.247 1.965 . . . . 0.0 111.278 170.802 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -61.58 -38.28 86.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.658 -171.421 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.63 -25.19 75.79 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.161 -0.542 . . . . 0.0 113.548 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.575 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 86.3 m95 -83.78 144.14 29.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.515 0.674 . . . . 0.0 112.676 -174.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.54 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 2.0 mt-10 -127.29 149.31 50.08 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.095 174.883 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -96.88 102.89 14.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.697 177.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.507 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.6 mt-10 -105.48 178.86 4.44 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.989 0.423 . . . . 0.0 110.424 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.8 m -131.5 139.58 49.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.325 176.082 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.401 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -78.52 176.64 9.22 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.338 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.477 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 2.4 pt-20 -67.29 -26.34 66.49 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.771 -174.163 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.401 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 35.6 m-80 -84.9 -35.11 22.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.963 0.411 . . . . 0.0 110.219 -179.354 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 126.15 15.09 2.87 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.216 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -83.52 142.52 30.84 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 174.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -90.97 154.94 3.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.303 0.573 . . . . 0.0 110.507 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.438 ' CB ' ' HA ' ' A' ' 38' ' ' TYR . 50.6 p90 -161.96 161.08 28.47 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.264 178.53 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -116.88 139.96 50.01 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.045 -176.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.547 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.77 123.68 52.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.218 0.532 . . . . 0.0 111.515 -177.916 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -73.03 114.62 11.39 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 170.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.54 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 50.3 m-70 -84.98 -4.13 59.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.789 0.328 . . . . 0.0 111.375 -175.406 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.5 mm -95.97 -49.78 12.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.4 0.619 . . . . 0.0 109.952 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -98.43 -5.89 31.6 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.04 -177.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.16 56.32 1.77 Allowed 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 175.261 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.516 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -119.13 120.68 37.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.738 177.896 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.547 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -105.0 116.2 31.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.312 179.331 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.413 HG22 ' CZ3' ' A' ' 16' ' ' TRP . 1.2 t -126.05 132.29 51.99 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.673 0.273 . . . . 0.0 110.429 177.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.438 ' HA ' ' CB ' ' A' ' 27' ' ' PHE . 8.2 m-85 -72.87 -25.52 61.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.019 0.438 . . . . 0.0 111.104 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.33 170.4 7.95 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.629 178.513 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 t0 . . . . . 0 C--N 1.323 -0.581 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.594 -175.272 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.617 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 15.9 mt . . . . . 0 N--CA 1.447 -0.606 0 CA-C-O 120.915 0.388 . . . . 0.0 111.463 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.451 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 46.4 Cg_exo -59.25 175.82 0.65 Allowed 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.382 2.722 . . . . 0.0 111.704 170.248 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -64.53 -40.1 94.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.258 -173.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.1 -29.28 73.32 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.828 -0.701 . . . . 0.0 113.021 -178.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.617 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 92.0 m95 -82.44 132.5 35.21 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -173.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.407 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -115.31 142.24 46.95 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.852 174.758 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -91.22 102.77 15.49 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 176.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.665 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.6 mm-40 -110.57 168.82 9.18 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.296 0.57 . . . . 0.0 111.069 -175.421 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.1 m -122.99 135.15 54.36 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.661 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.52 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -83.07 -179.1 7.34 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.415 179.567 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.472 ' HG2' ' H ' ' A' ' 22' ' ' GLU . 1.6 pt-20 -72.61 -15.98 61.73 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.515 -175.001 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.52 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 38.5 m-80 -88.31 -10.66 48.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.909 0.385 . . . . 0.0 110.314 177.263 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.17 17.22 57.94 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.787 -177.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -91.92 144.56 25.34 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.414 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -88.15 156.24 3.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.349 0.595 . . . . 0.0 110.81 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.453 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.5 p90 -162.21 160.61 27.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.096 177.249 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -116.82 135.28 53.86 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.219 -176.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.824 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.4 124.09 54.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 120.904 0.383 . . . . 0.0 110.825 179.704 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.546 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 1.4 t0 -76.78 131.64 38.82 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 170.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.407 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 70.8 m-70 -97.9 -0.75 44.37 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 121.003 -0.279 . . . . 0.0 111.651 -172.54 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.8 mt -92.58 -55.29 6.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.896 177.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -95.53 -14.96 23.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.748 0.308 . . . . 0.0 110.18 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 2.0 mmtt 70.58 71.76 0.2 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.98 176.522 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.578 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.6 mtp180 -122.38 119.12 30.1 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.24 174.392 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.824 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -104.01 114.09 28.09 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.469 178.833 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.31 138.59 53.08 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.666 0.269 . . . . 0.0 111.134 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -78.42 -14.65 59.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.848 0.356 . . . . 0.0 110.857 175.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.503 HD22 ' HA ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -102.86 155.57 18.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.497 -178.386 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.2 t0 . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.199 -175.707 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.686 0 N-CA-C 111.991 -0.443 . . . . 0.0 111.991 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.39 -20.83 50.35 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.671 0.236 . . . . 0.0 110.86 -178.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.15 33.26 22.68 Favored 'General case' 0 C--O 1.233 0.192 0 O-C-N 123.669 0.606 . . . . 0.0 111.0 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.01 60.67 4.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.943 -176.285 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.532 ' HA ' ' HD2' ' A' ' 5' ' ' ARG . 4.5 tpt85 -142.46 -35.84 0.42 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.279 177.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.2 mtmm -140.05 127.82 21.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.268 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.29 53.02 2.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.014 0.435 . . . . 0.0 110.688 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.1 p -139.73 126.7 23.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.123 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -167.83 -36.4 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.842 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.57 45.11 2.19 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 111.358 -0.697 . . . . 0.0 111.358 -174.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -82.55 -68.58 0.69 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.002 0.43 . . . . 0.0 111.047 -176.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 34.6 mt -83.5 161.81 55.42 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.353 -177.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.473 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 23.6 Cg_exo -65.61 159.38 48.44 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.87 2.38 . . . . 0.0 111.396 173.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.5 137.23 36.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 121.125 0.488 . . . . 0.0 110.128 171.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.56 -43.06 1.76 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.484 -175.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.473 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 95.2 m95 -75.94 132.87 40.52 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.943 0.719 . . . . 0.0 112.943 -175.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -114.09 142.87 45.66 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.722 174.021 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -97.4 117.1 30.89 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.3 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -127.41 174.54 8.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.087 0.47 . . . . 0.0 110.478 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -132.29 140.33 48.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.082 176.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.488 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -87.84 -173.81 4.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.074 0.464 . . . . 0.0 111.068 -178.501 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.542 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -73.56 -20.89 60.51 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.593 -176.885 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.488 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 44.0 m-80 -85.95 -6.4 59.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.098 0.475 . . . . 0.0 110.395 179.142 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.25 12.82 78.19 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.757 -178.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.49 124.59 32.98 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.072 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.9 p -73.6 145.63 11.33 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 120.048 -0.661 . . . . 0.0 110.381 178.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -148.31 159.35 44.08 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.263 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.522 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 18.6 m-85 -120.51 137.77 54.19 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.091 -175.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.632 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.13 118.61 37.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-O 121.38 0.609 . . . . 0.0 110.701 -178.302 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.598 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -76.27 138.71 40.73 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.948 176.0 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -109.38 23.5 14.38 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.045 0.45 . . . . 0.0 111.176 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.8 mm -103.07 -53.8 7.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.483 175.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.9 -22.3 15.86 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.263 175.228 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.598 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 1.0 OUTLIER 77.11 62.64 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.907 172.925 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.485 ' HG3' ' OD2' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -122.49 123.58 41.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.929 0.395 . . . . 0.0 111.311 174.936 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.632 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -87.42 119.72 27.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.108 175.015 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.438 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 6.3 t -123.76 136.68 54.57 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.15 0.5 . . . . 0.0 110.422 178.543 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -89.77 11.9 18.7 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.823 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.503 HD22 ' HA ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -122.0 156.92 32.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.445 179.129 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.531 ' OD1' ' HB2' ' A' ' 42' ' ' ARG . 8.3 t70 -74.1 118.01 66.07 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.925 -177.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.522 ' HD3' ' CD2' ' A' ' 28' ' ' PHE . 53.8 Cg_endo -94.18 43.75 0.22 Allowed 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 123.186 2.591 . . . . 0.0 112.666 -178.232 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.531 ' HB2' ' OD1' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -118.01 -4.45 11.05 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.073 176.67 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.7 -79.78 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 O-C-N 123.577 0.548 . . . . 0.0 112.061 -175.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -104.96 9.54 34.52 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.38 0.61 . . . . 0.0 110.712 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -102.16 64.92 0.95 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.814 -176.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.9 m -80.04 132.21 35.94 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.503 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.7 t -78.1 118.69 25.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.213 -178.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -97.78 96.92 8.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.462 177.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.595 ' HB3' ' HD3' ' A' ' 51' ' ' PRO . 2.5 t0 58.37 -162.7 0.22 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.282 -175.041 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.534 ' N ' ' HD3' ' A' ' 51' ' ' PRO . 1.9 p30 -147.31 55.38 2.34 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-O 120.613 0.244 . . . . 0.0 110.644 174.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.595 ' HD3' ' HB3' ' A' ' 49' ' ' ASP . 83.2 Cg_endo -96.42 -178.31 0.4 Allowed 'Trans proline' 0 N--CA 1.448 -1.171 0 C-N-CA 122.602 2.201 . . . . 0.0 112.132 -178.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.5 m -82.11 64.63 6.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.373 0.606 . . . . 0.0 109.766 173.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -94.77 121.28 63.26 Favored Pre-proline 0 N--CA 1.449 -0.5 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.911 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 1.3 Cg_endo . . . . . 0 C--O 1.246 0.906 0 C-N-CA 123.38 2.72 . . . . 0.0 111.251 175.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.915 0 N-CA-C 111.789 -0.524 . . . . 0.0 111.789 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -108.86 147.54 31.98 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 177.253 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.18 -135.66 0.21 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.548 -0.297 . . . . 0.0 110.606 -179.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -163.85 169.25 18.49 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -71.36 -79.51 0.07 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 173.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.08 40.81 18.23 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.318 173.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.1 mtp180 -138.54 45.84 2.03 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.1 0.476 . . . . 0.0 109.884 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.1 t -103.64 -53.53 7.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.379 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -143.47 134.66 25.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.85 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -138.98 115.66 1.16 Allowed Glycine 0 N--CA 1.445 -0.715 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 176.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.81 -46.92 64.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.172 0.511 . . . . 0.0 110.869 -178.174 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.468 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 4.2 mt -79.3 171.95 11.15 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.89 178.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.56 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.5 Cg_exo -57.53 163.09 9.17 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.309 2.006 . . . . 0.0 111.546 170.426 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.81 -34.06 71.08 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.414 -172.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -75.91 -23.74 71.28 Favored Glycine 0 CA--C 1.518 0.222 0 C-N-CA 121.083 -0.579 . . . . 0.0 113.278 -178.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.56 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 85.4 m95 -86.14 147.36 26.18 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.464 0.649 . . . . 0.0 112.654 -175.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.421 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 4.2 mm-40 -125.13 138.65 54.16 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.561 173.084 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -91.29 95.3 9.95 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.629 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.4 mm-40 -104.9 166.68 10.22 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.025 -175.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.0 m -124.72 137.65 54.33 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.565 176.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.91 -178.31 6.79 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.392 0.615 . . . . 0.0 110.814 -179.014 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.508 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -69.23 -29.02 66.86 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.753 -176.7 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -75.02 -33.17 61.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.237 0.542 . . . . 0.0 109.738 178.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 113.6 21.25 5.83 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.934 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -96.5 131.95 42.57 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 174.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -78.63 151.13 5.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.504 0.668 . . . . 0.0 110.349 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.4 p90 -154.56 161.2 41.74 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.289 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.443 ' CD1' HD11 ' A' ' 12' ' ' LEU . 14.1 m-85 -116.58 131.69 56.88 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.281 -176.021 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.718 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -128.94 123.8 59.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.278 0.561 . . . . 0.0 110.917 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -72.91 119.71 17.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 171.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.421 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 38.3 m-70 -89.51 0.73 56.68 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.276 0.56 . . . . 0.0 111.295 -174.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 12.3 mt -105.34 -52.53 7.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.871 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.472 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 71.0 m-80 -89.09 6.29 40.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.937 -178.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 33' ' ' ASN . 0.0 OUTLIER 42.27 53.9 4.35 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.607 1.163 . . . . 0.0 113.61 177.695 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.546 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 8.7 mtp180 -116.01 124.07 49.57 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 122.182 -0.324 . . . . 0.0 110.322 176.092 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.718 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.96 112.82 26.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.405 177.989 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.436 HG22 ' CZ3' ' A' ' 16' ' ' TRP . 12.4 t -126.21 139.71 53.13 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 120.877 0.37 . . . . 0.0 110.827 -179.318 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -91.2 5.42 49.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.87 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.612 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -121.08 165.87 14.71 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.883 178.418 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.612 ' H ' HD13 ' A' ' 39' ' ' LEU . 32.8 t0 -74.26 111.79 14.24 Favored Pre-proline 0 C--N 1.327 -0.399 0 O-C-N 123.4 0.438 . . . . 0.0 110.491 -178.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.518 ' O ' ' HB2' ' A' ' 45' ' ' PHE . 72.6 Cg_endo -80.76 7.87 4.61 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.867 2.378 . . . . 0.0 112.607 -176.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.5 mtp180 -103.68 -3.83 24.56 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.67 0.272 . . . . 0.0 110.774 176.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 28.5 mt -74.12 -81.34 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.623 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -93.23 7.54 43.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.218 0.532 . . . . 0.0 111.584 -175.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.518 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 7.0 m-85 -117.62 55.05 0.87 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.043 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -65.43 0.68 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.616 -177.345 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -70.56 -67.12 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.473 179.19 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -167.99 156.25 8.89 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 177.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -80.21 84.1 5.95 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 176.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.631 ' N ' ' HD3' ' A' ' 51' ' ' PRO . 7.5 t-20 -143.0 49.99 1.33 Allowed Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.339 -178.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.631 ' HD3' ' N ' ' A' ' 50' ' ' ASN . 1.5 Cg_endo -84.82 -30.94 0.47 Allowed 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.298 1.999 . . . . 0.0 111.93 175.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -143.24 -91.61 0.12 Allowed 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.205 0.526 . . . . 0.0 110.777 -177.569 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.92 120.62 3.63 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.507 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo . . . . . 0 C--O 1.252 1.183 0 C-N-CA 122.806 2.337 . . . . 0.0 112.147 -178.09 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.981 0 N-CA-C 111.786 -0.526 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.62 83.65 1.14 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.245 0.545 . . . . 0.0 111.174 -179.456 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -127.97 169.79 13.6 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.323 178.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.98 148.08 36.22 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.596 ' HE ' ' HA ' ' A' ' 49' ' ' ASP . 2.0 ttp85 -71.44 146.22 48.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.985 0.421 . . . . 0.0 111.319 -177.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.76 170.75 16.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.167 177.08 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.469 ' HD3' ' HA ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -77.76 95.19 4.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.976 0.417 . . . . 0.0 110.157 178.226 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.28 165.56 3.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.859 178.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 12' ' ' LEU . . . -152.33 -164.48 1.97 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.388 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -68.5 -66.88 2.13 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 121.144 -0.551 . . . . 0.0 112.913 -177.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.55 -84.39 0.1 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -179.158 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.659 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 0.1 OUTLIER -103.2 154.9 37.33 Favored Pre-proline 0 CA--C 1.515 -0.381 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 170.391 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.583 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 32.4 Cg_exo -57.24 167.46 3.44 Favored 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.315 2.01 . . . . 0.0 111.187 169.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.441 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 0.3 OUTLIER -55.94 -37.48 69.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.057 -174.09 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -78.42 -23.73 64.69 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.647 -0.787 . . . . 0.0 113.113 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.659 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 92.6 m95 -87.9 144.58 26.49 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -173.656 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.44 ' HB2' ' HD2' ' A' ' 31' ' ' HIS . 1.8 mm-40 -130.26 146.48 51.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.664 176.455 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -97.43 104.38 16.39 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.985 0.422 . . . . 0.0 110.432 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.638 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.2 mt-10 -114.18 165.23 12.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.017 -178.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.43 145.37 44.18 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.933 0.397 . . . . 0.0 110.567 177.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.403 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -81.04 -177.93 6.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.975 0.416 . . . . 0.0 110.353 179.158 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.405 ' HG3' ' H ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -65.68 -28.16 68.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.668 -175.929 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.403 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 3.9 m-80 -85.18 -46.12 11.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.159 0.504 . . . . 0.0 110.737 -178.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.69 12.15 0.8 Allowed Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.899 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.48 133.67 34.46 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 175.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.5 p -86.16 153.93 3.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.428 0.632 . . . . 0.0 110.983 -178.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.638 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 54.4 p90 -155.29 163.0 40.73 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.834 -1.075 . . . . 0.0 109.263 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.688 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 11.4 m-85 -118.92 137.87 53.17 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.826 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.531 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -130.75 125.06 57.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 121.162 0.505 . . . . 0.0 111.269 -178.047 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.422 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 54.2 t0 -76.68 99.26 5.0 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 173.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.44 ' HD2' ' HB2' ' A' ' 17' ' ' GLU . 30.8 m-70 -75.82 -7.43 54.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.698 0.285 . . . . 0.0 111.193 -172.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 46.6 mm -63.29 -48.94 85.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.124 0.488 . . . . 0.0 110.317 176.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.69 2.47 14.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.598 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.496 ' HE3' ' N ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER 60.61 62.99 1.4 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.588 176.307 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.422 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -122.84 125.34 45.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.753 0.311 . . . . 0.0 110.376 173.486 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.451 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -97.7 120.56 38.3 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.944 -178.707 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.561 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 12.8 t -126.37 139.28 53.4 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.152 0.501 . . . . 0.0 110.441 176.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -85.63 -12.05 52.37 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.368 0.604 . . . . 0.0 110.027 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.474 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -83.53 149.67 26.46 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.348 179.442 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.507 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 0.8 OUTLIER -78.77 119.52 77.56 Favored Pre-proline 0 N--CA 1.437 -1.089 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.166 -176.011 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.688 ' HD3' ' CD2' ' A' ' 28' ' ' PHE . 1.5 Cg_endo -86.39 39.36 0.64 Allowed 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 123.231 2.621 . . . . 0.0 112.152 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.428 HH11 ' HB2' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -112.14 36.27 3.42 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.27 0.557 . . . . 0.0 109.835 -179.703 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mt -112.57 -81.65 0.59 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.18 -177.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.68 3.25 41.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.253 0.549 . . . . 0.0 111.441 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -90.25 78.21 6.57 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.924 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -138.65 -170.25 2.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.635 -178.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 6.8 t -84.54 63.53 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.466 0.65 . . . . 0.0 111.053 -178.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -110.59 126.8 54.83 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 170.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.596 ' HA ' ' HE ' ' A' ' 5' ' ' ARG . 3.4 t0 -59.2 -81.19 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -171.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.8 t30 40.76 67.38 2.91 Favored Pre-proline 0 N--CA 1.47 0.567 0 O-C-N 124.084 0.865 . . . . 0.0 111.531 -174.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -80.39 51.3 3.86 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.737 2.291 . . . . 0.0 112.761 -175.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.29 163.13 27.32 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.901 0.381 . . . . 0.0 110.665 178.141 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.4 mmtt -66.56 151.05 96.85 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.862 176.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo . . . . . 0 C--O 1.247 0.956 0 C-N-CA 122.961 2.441 . . . . 0.0 112.477 -178.696 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.721 0 N-CA-C 111.836 -0.506 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.24 82.2 3.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.039 0.447 . . . . 0.0 110.614 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -140.58 114.19 8.79 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.466 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.546 ' HB2' ' HE2' ' A' ' 6' ' ' LYS . 3.1 pttt -60.98 -38.35 85.67 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.875 -179.486 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 54.06 43.93 30.02 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.728 176.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.546 ' HE2' ' HB2' ' A' ' 4' ' ' LYS . 8.4 mmtt -80.89 77.43 7.77 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 6' ' ' LYS . 17.1 mmt180 74.19 -48.76 0.66 Allowed 'General case' 0 N--CA 1.469 0.522 0 O-C-N 124.023 0.827 . . . . 0.0 110.689 -176.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 21.7 t -75.52 120.76 25.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.742 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -141.54 -24.84 0.71 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.431 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.04 41.47 60.78 Favored Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 -178.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -108.61 -45.35 3.87 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.86 0.362 . . . . 0.0 111.684 -174.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.0 mt -95.95 161.02 28.75 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.372 -171.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.456 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.0 Cg_exo -58.82 174.67 0.77 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.455 2.77 . . . . 0.0 112.319 170.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -64.77 -41.09 96.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.403 -175.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.34 -25.25 75.64 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.882 -0.675 . . . . 0.0 113.256 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.456 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 92.1 m95 -87.57 142.94 27.46 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.412 0.625 . . . . 0.0 112.601 -175.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.37 154.06 34.19 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.063 174.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -105.23 101.88 11.4 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.632 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.3 mm-40 -113.17 165.52 12.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.678 -175.504 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.7 m -116.45 138.25 51.52 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.794 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.78 178.6 7.24 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 121.343 0.592 . . . . 0.0 110.506 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.512 ' HG2' ' H ' ' A' ' 22' ' ' GLU . 0.5 OUTLIER -59.68 -39.58 84.98 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.125 -177.239 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -73.08 -49.59 27.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.778 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 139.42 10.88 0.79 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.974 -0.631 . . . . 0.0 112.033 -178.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -85.66 143.17 28.56 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.4 p -86.35 156.7 3.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.233 0.539 . . . . 0.0 111.052 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.506 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 45.9 p90 -158.85 161.91 36.91 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.608 178.236 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.439 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 12.9 m-85 -116.97 132.52 56.68 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.442 -176.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.632 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -130.02 130.0 65.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.836 179.017 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.49 132.4 36.32 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 172.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.0 m-70 -100.77 15.76 27.27 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.251 -0.58 . . . . 0.0 111.666 -173.079 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.2 mt -99.01 -54.27 7.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.078 173.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.443 ' O ' ' HB2' ' A' ' 34' ' ' LYS . 3.5 m120 -95.15 -15.97 22.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.249 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 33' ' ' ASN . 0.4 OUTLIER 74.31 39.49 0.47 Allowed 'General case' 0 N--CA 1.464 0.271 0 O-C-N 124.191 0.932 . . . . 0.0 111.529 177.796 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.503 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 58.5 mtp180 -89.8 136.01 33.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.86 0.362 . . . . 0.0 110.538 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -115.89 118.06 31.93 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.377 -178.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.427 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 2.3 t -125.46 131.94 52.78 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.004 0.431 . . . . 0.0 110.263 176.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -88.91 0.08 56.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.46 0.647 . . . . 0.0 109.926 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.92 163.45 15.54 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.031 176.465 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.551 ' OD1' ' HG2' ' A' ' 42' ' ' ARG . 32.3 t0 -66.78 121.23 76.69 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.715 -178.236 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.634 ' O ' ' HB2' ' A' ' 45' ' ' PHE . 9.5 Cg_exo -70.61 -17.97 33.35 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.343 2.695 . . . . 0.0 113.582 -175.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.551 ' HG2' ' OD1' ' A' ' 40' ' ' ASP . 6.1 ptp85 -88.75 5.95 41.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.993 0.425 . . . . 0.0 110.885 -177.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.548 ' CD1' ' HB3' ' A' ' 40' ' ' ASP . 86.3 mt -88.54 -93.84 0.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.457 178.342 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.66 3.6 40.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.907 -172.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.634 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 44.9 m-85 -105.86 5.96 31.14 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.103 0.478 . . . . 0.0 110.065 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.77 99.54 3.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.149 179.562 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 77.0 152.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.37 0 C-N-CA 123.505 0.722 . . . . 0.0 112.149 175.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 17.9 t70 70.99 85.85 0.13 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.086 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.25 134.28 44.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.549 -178.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.543 ' H ' ' HD2' ' A' ' 51' ' ' PRO . 50.3 t30 -167.8 -52.16 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.41 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.543 ' HD2' ' H ' ' A' ' 50' ' ' ASN . 61.3 Cg_endo -73.75 53.67 2.83 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 121.929 1.752 . . . . 0.0 112.461 178.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.25 35.62 2.05 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.747 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -160.18 100.88 1.41 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.695 179.033 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 5.5 Cg_exo . . . . . 0 C--O 1.248 1.008 0 C-N-CA 123.279 2.652 . . . . 0.0 112.278 -176.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.802 0 N-CA-C 112.249 -0.34 . . . . 0.0 112.249 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.4 -82.15 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.114 0.566 . . . . 0.0 111.68 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.4 122.71 48.48 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.977 0.417 . . . . 0.0 110.904 -177.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.08 101.16 6.16 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.872 176.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.531 ' HG3' ' H ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -71.85 154.47 41.24 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.135 179.441 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 62.89 54.14 2.28 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.231 0.539 . . . . 0.0 110.026 -176.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.1 ptt-85 -107.78 23.78 13.95 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.772 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -86.41 54.53 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.047 -178.263 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -104.05 119.22 38.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.22 -178.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.15 65.65 4.09 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.969 -0.634 . . . . 0.0 111.985 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -101.9 -51.63 3.37 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.391 0.615 . . . . 0.0 110.513 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.58 170.79 5.77 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.318 -176.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.525 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 72.4 Cg_exo -52.53 168.62 0.42 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.137 2.558 . . . . 0.0 112.033 168.481 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -64.89 -38.36 90.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.165 -173.468 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.73 -27.04 71.48 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.056 -0.593 . . . . 0.0 113.05 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.525 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 94.2 m95 -85.21 141.94 29.79 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -176.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -124.29 138.75 54.36 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.92 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -88.08 100.6 13.06 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.265 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -100.96 172.23 7.15 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.506 -178.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 m -134.25 134.69 42.27 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.33 174.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.6 -174.28 5.19 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.527 -175.352 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.429 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -70.58 -31.58 68.64 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.311 -177.44 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -76.17 -25.65 55.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.36 0.6 . . . . 0.0 109.903 178.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 105.95 12.07 26.75 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.769 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.97 144.19 30.16 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 174.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.1 p -86.94 153.87 3.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-O 121.145 0.498 . . . . 0.0 110.25 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -159.41 156.69 28.87 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.171 178.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -113.18 132.72 55.37 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.012 -175.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.645 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -125.41 123.54 65.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-O 121.474 0.654 . . . . 0.0 111.169 -179.145 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.622 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 12.1 t0 -77.38 133.57 38.66 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.528 172.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.4 m-70 -100.84 -2.84 31.11 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 120.711 0.291 . . . . 0.0 111.271 -174.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.2 mt -88.09 -61.72 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 120.899 0.381 . . . . 0.0 110.304 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.524 ' C ' ' HG2' ' A' ' 34' ' ' LYS . 3.1 p30 -106.91 23.25 14.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.102 0.477 . . . . 0.0 110.615 178.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.622 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.0 OUTLIER 38.1 75.38 0.07 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.799 1.24 . . . . 0.0 113.894 173.499 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.477 ' HD3' ' CH2' ' A' ' 16' ' ' TRP . 0.0 OUTLIER -122.23 119.41 31.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.715 0.293 . . . . 0.0 110.401 172.944 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.645 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -99.83 113.99 26.87 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.195 178.01 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.54 HG21 ' HB3' ' A' ' 41' ' ' PRO . 1.7 t -126.33 132.87 51.52 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.391 0.139 . . . . 0.0 110.735 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -76.6 -26.89 55.48 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.212 0.53 . . . . 0.0 110.306 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.26 168.82 8.93 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.357 -178.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.512 ' OD2' ' HG ' ' A' ' 43' ' ' LEU . 13.5 t70 -63.54 125.92 88.45 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.052 -176.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.54 ' HB3' HG21 ' A' ' 37' ' ' THR . 93.5 Cg_endo -88.79 35.71 0.39 Allowed 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 123.367 2.712 . . . . 0.0 112.623 -178.102 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -127.82 -31.58 2.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.848 179.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.512 ' HG ' ' OD2' ' A' ' 40' ' ' ASP . 11.6 mt -50.96 -71.63 0.06 Allowed 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.728 0.643 . . . . 0.0 111.966 -176.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -104.93 8.38 34.56 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.064 0.459 . . . . 0.0 110.865 -178.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -102.52 24.31 10.6 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.62 -177.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.79 -102.44 0.37 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.19 178.227 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.11 -44.34 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.058 176.103 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.1 30.55 20.0 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.373 177.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -156.75 34.64 0.3 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.666 177.752 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.551 ' HB3' ' HD3' ' A' ' 51' ' ' PRO . 4.6 t-20 -123.66 -50.79 0.04 OUTLIER Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.692 -177.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.551 ' HD3' ' HB3' ' A' ' 50' ' ' ASN . 24.9 Cg_exo -63.77 -90.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.017 1.812 . . . . 0.0 112.109 177.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.471 ' H ' ' HB2' ' A' ' 51' ' ' PRO . 1.8 m -140.77 99.48 3.62 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.03 0.443 . . . . 0.0 110.676 177.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.8 -47.18 1.79 Allowed Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.263 176.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo . . . . . 0 C--N 1.358 1.065 0 C-N-CA 121.949 1.766 . . . . 0.0 111.924 175.584 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 N-CA-C 111.776 -0.529 . . . . 0.0 111.776 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.16 2.91 56.31 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -177.226 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -88.58 26.78 1.4 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.805 0.336 . . . . 0.0 111.636 -175.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.89 6.37 39.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.622 178.089 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.9 mtt85 72.45 167.68 0.31 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.094 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -89.72 50.11 1.84 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.075 0.464 . . . . 0.0 110.592 -177.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -85.24 61.67 7.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.204 -177.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.4 p -124.2 94.2 2.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.876 0.846 . . . . 0.0 110.587 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -99.86 62.59 1.16 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.95 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.68 -54.78 4.96 Favored Glycine 0 N--CA 1.451 -0.33 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.684 -175.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.59 ' HA ' HH21 ' A' ' 42' ' ' ARG . 2.6 t70 -92.47 -167.2 1.7 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 176.259 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.41 ' CD2' ' HD2' ' A' ' 41' ' ' PRO . 0.5 OUTLIER -78.78 168.97 22.87 Favored Pre-proline 0 C--N 1.317 -0.819 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.988 175.884 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.59 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 42.9 Cg_exo -56.53 158.11 16.9 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 121.874 1.716 . . . . 0.0 110.911 169.382 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -36.73 70.01 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.101 -0.499 . . . . 0.0 112.072 -171.081 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.32 -30.37 75.3 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.877 -0.677 . . . . 0.0 113.249 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.638 ' HZ3' HG22 ' A' ' 37' ' ' THR . 86.6 m95 -81.39 130.38 35.02 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -173.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.426 ' OE1' ' HA ' ' A' ' 17' ' ' GLU . 4.9 mm-40 -114.25 150.98 33.55 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.015 174.45 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -96.7 104.62 16.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.821 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.611 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 0.8 OUTLIER -115.63 166.2 12.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.137 0.494 . . . . 0.0 110.64 -176.94 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.03 139.89 53.4 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.587 174.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.453 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -81.3 -179.07 7.2 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.382 0.61 . . . . 0.0 110.713 -179.273 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.33 -11.51 60.73 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.013 -173.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.453 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 29.5 m-80 -101.81 -6.32 23.75 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.056 0.455 . . . . 0.0 110.252 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 91.12 16.11 54.56 Favored Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.969 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -89.46 125.45 35.18 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 175.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 6.0 p -75.89 150.96 6.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.471 0.653 . . . . 0.0 110.992 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 41.1 p90 -156.17 158.53 37.79 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.541 -1.208 . . . . 0.0 108.76 176.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -119.01 136.59 54.04 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.507 -176.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.633 ' HA ' ' O ' ' A' ' 35' ' ' ARG . 0.2 OUTLIER -133.27 124.28 48.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.482 0.658 . . . . 0.0 111.979 -176.509 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.451 ' HB2' ' CE2' ' A' ' 16' ' ' TRP . 50.4 t0 -74.05 109.58 7.66 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.308 171.144 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 43.2 m-70 -82.52 -1.54 50.81 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.07 0.462 . . . . 0.0 111.101 -175.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.8 mm -97.03 -52.94 8.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.835 176.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -90.7 -5.42 55.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.159 -178.048 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 62.15 61.29 1.35 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.455 176.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.633 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -123.8 118.94 28.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.688 177.102 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.526 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.01 109.41 21.4 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.483 176.433 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.638 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 8.8 t -123.85 136.76 54.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.189 0.519 . . . . 0.0 110.72 -178.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -83.71 5.2 25.52 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.257 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.44 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -112.32 152.89 28.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.77 0.319 . . . . 0.0 110.639 179.05 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.602 ' OD1' ' HG2' ' A' ' 42' ' ' ARG . 17.4 t0 -78.01 114.68 44.1 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.343 -174.43 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.472 ' HA ' ' CE1' ' A' ' 45' ' ' PHE . 5.6 Cg_exo -80.76 20.37 0.99 Allowed 'Trans proline' 0 CA--C 1.534 0.488 0 C-N-CA 123.667 2.912 . . . . 0.0 113.437 -179.09 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.602 ' HG2' ' OD1' ' A' ' 40' ' ' ASP . 3.1 ptp85 -108.57 -1.07 19.94 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.201 176.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mt -87.92 -79.95 0.28 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.857 0.361 . . . . 0.0 111.81 -176.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.78 11.36 6.04 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -172.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.472 ' CE1' ' HA ' ' A' ' 41' ' ' PRO . 5.6 m-85 -96.82 -15.14 21.44 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.409 0.623 . . . . 0.0 110.346 -179.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.33 75.81 8.28 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.765 178.006 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -76.47 59.16 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.091 0.472 . . . . 0.0 110.277 176.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -84.32 -44.74 13.51 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.198 -178.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -90.61 162.24 15.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.892 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -83.59 120.17 74.94 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.439 -178.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -81.0 66.99 8.79 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.873 2.382 . . . . 0.0 112.488 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -70.63 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.803 177.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -171.03 130.29 0.78 Allowed Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.442 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo . . . . . 0 C--O 1.25 1.102 0 C-N-CA 122.657 2.238 . . . . 0.0 111.97 -179.458 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.636 0 N-CA-C 112.167 -0.373 . . . . 0.0 112.167 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.34 -38.01 5.84 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.909 0.385 . . . . 0.0 110.397 178.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.72 164.98 25.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.608 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.87 67.35 5.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.171 0.51 . . . . 0.0 110.813 -177.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.47 -24.91 17.11 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.313 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.9 mtpp 60.31 -107.08 0.29 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.293 178.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -165.58 -58.56 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.317 0.58 . . . . 0.0 109.525 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.0 t -131.14 117.98 39.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.225 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -122.7 10.9 9.71 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.27 0.557 . . . . 0.0 109.938 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.06 -123.35 6.31 Favored Glycine 0 N--CA 1.443 -0.884 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.563 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.403 ' HB3' ' H ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER -100.61 -88.89 0.35 Allowed 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 175.995 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.497 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 49.3 mt -89.77 161.49 38.64 Favored Pre-proline 0 N--CA 1.446 -0.643 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 168.104 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.588 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 49.9 Cg_exo -56.29 163.53 6.32 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 121.759 1.639 . . . . 0.0 110.925 174.394 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -55.6 -38.3 69.25 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.949 -170.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -76.29 -25.32 66.28 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.147 -0.549 . . . . 0.0 114.323 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.588 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 88.5 m95 -83.99 143.55 29.72 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -172.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.425 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -121.15 149.54 42.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.634 173.595 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -98.82 103.09 15.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.107 0.479 . . . . 0.0 109.769 179.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -105.31 167.22 9.88 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.143 -177.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.9 m -134.57 138.8 44.89 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.077 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.483 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -78.18 172.29 13.78 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 121.349 0.595 . . . . 0.0 109.47 178.185 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -72.47 -10.37 59.7 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.771 -172.029 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.483 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 35.5 m-80 -100.05 -1.59 36.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.265 0.555 . . . . 0.0 110.004 178.079 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 90.55 15.45 56.85 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.564 -0.744 . . . . 0.0 113.252 176.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -88.2 120.9 30.0 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 173.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -74.68 154.01 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.389 0.614 . . . . 0.0 110.829 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -160.75 155.26 23.51 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.293 176.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -113.12 136.98 52.12 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.951 -175.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.734 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.74 122.35 49.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.242 0.544 . . . . 0.0 111.087 -177.816 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.495 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -76.0 128.16 34.47 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 172.942 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.425 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 67.4 m-70 -99.05 15.07 27.03 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.806 0.336 . . . . 0.0 111.317 -175.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 21.9 mm -91.49 -55.52 6.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.085 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -120.64 3.01 10.69 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.5 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.0 OUTLIER 73.61 79.42 0.13 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.454 -0.793 . . . . 0.0 112.611 170.199 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.669 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -122.77 118.27 27.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.293 173.988 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.734 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.78 114.71 29.02 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.172 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.435 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 2.2 t -126.25 134.13 51.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.658 0.266 . . . . 0.0 110.772 -179.145 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -79.26 -17.83 53.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.142 0.496 . . . . 0.0 110.971 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.4 159.34 16.22 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.589 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.461 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 2.3 t70 -69.95 128.26 91.86 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.753 -176.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.473 ' HA ' ' CD1' ' A' ' 45' ' ' PHE . 2.7 Cg_exo -76.17 14.05 1.19 Allowed 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.289 2.66 . . . . 0.0 113.574 -175.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.28 -6.1 11.3 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 122.316 -0.24 . . . . 0.0 110.78 178.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.433 ' HG ' ' OD2' ' A' ' 40' ' ' ASP . 71.0 mt -83.92 -88.61 0.1 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.827 0.346 . . . . 0.0 111.295 -178.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -94.5 10.93 32.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.93 -176.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.473 ' CD1' ' HA ' ' A' ' 41' ' ' PRO . 50.4 m-85 -97.18 89.01 4.63 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.464 178.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -56.7 13.89 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.552 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 85.3 t -141.55 94.74 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.052 177.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -84.48 69.38 10.55 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.717 0.77 . . . . 0.0 109.643 176.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -159.26 -42.29 0.06 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.23 -177.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -113.01 143.85 29.95 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.767 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.35 -42.96 63.04 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.756 2.304 . . . . 0.0 112.705 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 58.5 44.1 18.42 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.803 0.811 . . . . 0.0 109.772 -175.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.796 ' HG2' ' HD2' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -149.06 150.37 32.02 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.153 -0.931 . . . . 0.0 109.786 -174.471 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.796 ' HD2' ' HG2' ' A' ' 53' ' ' LYS . 32.8 Cg_endo . . . . . 0 C--O 1.246 0.891 0 C-N-CA 122.227 1.951 . . . . 0.0 111.622 172.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.693 0 N-CA-C 111.862 -0.495 . . . . 0.0 111.862 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.71 142.67 51.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.852 0.358 . . . . 0.0 111.264 -178.379 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.04 71.62 0.76 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.85 176.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -82.51 55.97 3.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.62 -175.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -109.68 -175.11 2.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.834 -179.48 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.5 tptt -72.88 85.97 1.27 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.14 0.495 . . . . 0.0 109.702 175.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.518 ' HD2' ' HA ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -85.68 62.77 7.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.687 -175.482 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 1.03 ' HA ' ' HA ' ' A' ' 13' ' ' PRO . 3.4 m -101.45 150.22 6.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.67 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -106.53 10.64 31.2 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.324 0.583 . . . . 0.0 110.241 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 124.2 -91.46 0.43 Allowed Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.156 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -60.84 -78.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 175.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.553 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 84.2 mt -99.03 173.65 3.67 Favored Pre-proline 0 N--CA 1.449 -0.508 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.394 174.14 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 1.03 ' HA ' ' HA ' ' A' ' 8' ' ' VAL . 36.5 Cg_exo -63.63 177.4 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.393 2.062 . . . . 0.0 112.465 173.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.438 ' HB3' ' HG3' ' A' ' 7' ' ' ARG . 1.0 OUTLIER -58.39 -39.05 78.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.766 -171.769 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -90.99 -15.64 55.81 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.56 -0.829 . . . . 0.0 113.909 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.581 ' HZ3' HG22 ' A' ' 37' ' ' THR . 85.3 m95 -89.22 139.47 30.45 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -171.045 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -120.36 132.13 55.14 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.853 174.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -80.84 104.48 11.38 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 176.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.564 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.0 OUTLIER -114.93 164.5 14.05 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.371 -178.422 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 18.2 m -129.27 138.81 51.85 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.4 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.18 178.71 3.7 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.504 0.668 . . . . 0.0 110.946 -177.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.427 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -68.15 -19.94 64.85 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.864 -173.307 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -93.06 -43.81 8.7 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.443 -178.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 139.05 18.5 0.51 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.665 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.509 ' HB3' ' HE2' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -90.63 126.96 36.13 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 175.462 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -79.79 153.83 4.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 120.283 -0.567 . . . . 0.0 110.743 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.7 p90 -162.97 158.72 22.63 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.843 178.303 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -116.94 138.08 51.79 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.514 -177.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.619 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.8 124.35 53.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.364 0.602 . . . . 0.0 111.411 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -74.31 107.76 6.67 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 170.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -82.52 1.19 39.03 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.159 0.504 . . . . 0.0 111.117 -174.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.3 mm -97.73 -55.38 6.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.351 0.596 . . . . 0.0 109.623 176.163 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -92.56 -1.12 57.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.379 -176.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm 59.6 61.51 1.96 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.692 175.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.588 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -124.07 117.78 25.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.611 175.647 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.619 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -103.72 114.11 28.12 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.289 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.581 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 3.3 t -125.54 132.42 52.59 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.976 0.417 . . . . 0.0 110.746 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.509 ' HE2' ' HB3' ' A' ' 25' ' ' GLN . 26.0 m-85 -83.75 -4.91 59.01 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.764 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.583 HD12 ' H ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -115.54 172.08 7.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.436 175.942 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.583 ' H ' HD12 ' A' ' 39' ' ' LEU . 10.1 t70 -78.75 121.23 83.26 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.282 -174.588 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.457 ' O ' ' HB2' ' A' ' 45' ' ' PHE . 63.1 Cg_endo -94.81 7.24 2.2 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.155 2.57 . . . . 0.0 112.983 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -92.31 -14.49 28.72 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.311 -176.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.3 mt -70.24 -91.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.493 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -105.9 2.82 27.9 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -174.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 96.4 m-85 -91.97 15.79 12.47 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.326 -174.322 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.31 -11.31 14.88 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.844 0.354 . . . . 0.0 111.49 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.402 ' HB ' ' H ' ' A' ' 48' ' ' ASP . 0.0 OUTLIER -135.85 -146.3 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.165 -175.652 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.402 ' H ' ' HB ' ' A' ' 47' ' ' VAL . 1.2 t0 -86.96 -164.23 1.04 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.817 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -75.55 119.59 19.81 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.399 178.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.504 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 0.1 OUTLIER -77.15 126.35 85.41 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 179.093 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.504 ' HD3' ' HA ' ' A' ' 50' ' ' ASN . 31.1 Cg_endo -96.7 90.31 0.08 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.114 0 C-N-CA 123.426 2.751 . . . . 0.0 113.332 -178.21 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.5 15.38 11.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.751 0.786 . . . . 0.0 109.618 171.349 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.8 mtpt -105.69 149.21 37.65 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.334 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo . . . . . 0 C--O 1.249 1.066 0 C-N-CA 122.729 2.286 . . . . 0.0 112.169 177.769 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.825 0 N-CA-C 111.774 -0.53 . . . . 0.0 111.774 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.71 73.17 7.68 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.885 0.343 . . . . 0.0 110.846 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -77.07 -35.18 56.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.141 0.496 . . . . 0.0 110.512 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.39 72.21 10.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.197 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.2 ttm105 -81.82 133.33 35.32 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.515 -177.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.61 -178.97 6.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.779 173.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.43 88.67 0.9 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.492 0.663 . . . . 0.0 111.028 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.0 m -109.99 -11.96 11.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.651 176.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 66.66 -73.79 0.07 Allowed 'General case' 0 N--CA 1.467 0.41 0 O-C-N 123.939 0.775 . . . . 0.0 111.262 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -155.22 172.63 33.48 Favored Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 111.729 -0.549 . . . . 0.0 111.729 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -85.85 -4.48 59.18 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.286 0.565 . . . . 0.0 110.652 -179.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.666 HD11 ' HD1' ' A' ' 28' ' ' PHE . 43.9 mt -87.96 169.41 14.0 Favored Pre-proline 0 C--N 1.32 -0.714 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.436 -178.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.519 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 50.7 Cg_exo -59.39 173.9 1.27 Allowed 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 123.366 2.711 . . . . 0.0 112.348 170.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.4 -41.72 94.46 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.034 -175.088 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -74.48 -28.89 62.68 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.613 -177.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.544 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 91.6 m95 -83.84 134.53 34.7 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.252 0.549 . . . . 0.0 112.394 -173.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -119.35 143.09 47.59 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.563 174.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -94.34 106.76 18.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.922 0.391 . . . . 0.0 109.997 -177.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.572 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.5 mt-10 -114.85 167.8 10.46 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.373 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.2 m -124.29 136.63 54.27 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.173 175.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.1 177.32 9.03 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.099 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -64.92 -35.01 79.77 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.245 -176.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -67.05 -37.72 84.54 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.301 0.572 . . . . 0.0 109.82 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 116.6 15.96 6.68 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.343 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -87.69 137.69 32.12 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 173.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.9 p -84.26 145.5 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 120.015 -0.674 . . . . 0.0 109.938 178.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.533 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.2 p90 -147.18 155.49 42.16 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.502 -179.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.666 ' HD1' HD11 ' A' ' 12' ' ' LEU . 17.9 m-85 -114.35 132.17 56.29 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.872 -174.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.572 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -131.07 120.3 46.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-O 121.142 0.496 . . . . 0.0 110.85 -179.122 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.502 ' HB3' ' HD3' ' A' ' 35' ' ' ARG . 4.6 t0 -78.7 112.68 16.06 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 171.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.6 m-70 -82.82 -10.15 58.99 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.043 -172.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.0 mm -75.32 -56.54 8.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.943 ' HB2' ' HD2' ' A' ' 35' ' ' ARG . 61.9 m-80 -93.57 -5.08 49.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.599 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.5 mmtm 62.82 61.69 1.13 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.832 176.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.943 ' HD2' ' HB2' ' A' ' 33' ' ' ASN . 0.8 OUTLIER -122.74 123.34 40.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.56 176.3 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.56 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -105.23 117.41 33.93 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.692 179.809 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.537 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 1.8 t -125.49 130.97 52.84 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.892 0.377 . . . . 0.0 110.247 177.305 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.519 ' HA ' ' CB ' ' A' ' 27' ' ' PHE . 11.2 m-85 -78.53 -17.25 56.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.023 -177.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -112.88 166.47 11.36 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 120.87 0.366 . . . . 0.0 111.009 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -59.67 119.36 39.71 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.695 -177.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.528 ' HD3' ' CD2' ' A' ' 28' ' ' PHE . 97.4 Cg_endo -91.38 21.9 0.75 Allowed 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 123.236 2.624 . . . . 0.0 112.579 -179.042 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -118.44 2.18 11.82 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.929 0.395 . . . . 0.0 110.746 177.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.9 mt -77.95 -78.48 0.14 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.192 -177.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -97.91 8.77 44.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.09 0.471 . . . . 0.0 110.97 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.459 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 94.0 m-85 -100.61 61.64 1.02 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.37 0.605 . . . . 0.0 110.31 -177.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.05 179.21 7.64 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.32 -0.854 . . . . 0.0 108.884 177.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -80.79 56.53 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.498 0.666 . . . . 0.0 109.651 176.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -156.39 -178.61 7.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.608 -175.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -79.37 -68.09 0.69 Allowed 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 175.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 177.57 102.15 0.12 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.865 175.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -62.23 96.27 0.15 Allowed 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.679 2.253 . . . . 0.0 111.373 176.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -102.03 105.02 15.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.454 -174.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.452 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -108.02 119.04 51.22 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.848 177.226 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 22.7 Cg_exo . . . . . 0 C--O 1.249 1.061 0 C-N-CA 122.86 2.374 . . . . 0.0 112.186 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.664 0 N-CA-C 111.846 -0.502 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.5 m 56.33 -145.97 0.59 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.602 0.239 . . . . 0.0 110.832 -178.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -167.12 156.33 10.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.439 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.407 ' H ' ' HG3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -105.33 87.92 2.73 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.241 0.543 . . . . 0.0 109.543 175.349 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.49 -19.11 13.04 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.863 -177.352 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.32 73.25 10.16 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.784 -178.185 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -29.28 70.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.157 0.503 . . . . 0.0 110.028 175.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -94.77 72.36 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.613 174.11 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.79 138.28 41.09 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.981 -178.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -84.57 137.86 16.26 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.987 179.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -73.78 -177.21 2.69 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.922 0.391 . . . . 0.0 110.125 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.496 HD11 ' CD1' ' A' ' 28' ' ' PHE . 17.1 mt -96.01 156.74 36.79 Favored Pre-proline 0 C--N 1.313 -1.002 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.121 -171.091 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.501 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 76.8 Cg_exo -55.21 177.86 0.1 Allowed 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.6 2.867 . . . . 0.0 112.885 172.631 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -65.07 -43.12 93.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.54 -176.081 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.37 -28.94 72.02 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.249 -0.501 . . . . 0.0 112.613 -176.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.515 ' HZ3' HG22 ' A' ' 37' ' ' THR . 92.8 m95 -83.74 146.91 27.93 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -129.32 138.54 51.64 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.321 175.09 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -93.13 101.18 13.47 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.595 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 2.0 mt-10 -106.1 164.06 12.29 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.053 -178.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 12.7 m -125.65 134.28 51.92 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.018 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.419 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -73.67 172.94 10.5 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 121.269 0.556 . . . . 0.0 110.053 179.021 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.442 ' HG3' ' H ' ' A' ' 22' ' ' GLU . 0.3 OUTLIER -65.93 -27.14 67.95 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.484 -173.945 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.419 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 40.3 m-80 -76.98 -36.89 56.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.311 0.577 . . . . 0.0 109.68 177.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 126.79 7.6 5.07 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.891 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -78.02 116.43 18.5 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 176.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.2 p -74.14 154.76 6.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-O 121.176 0.513 . . . . 0.0 110.209 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.537 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 51.9 p90 -164.74 159.76 19.02 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.542 -0.753 . . . . 0.0 110.416 -177.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.496 ' CD1' HD11 ' A' ' 12' ' ' LEU . 6.9 m-85 -114.39 130.66 56.71 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.71 -176.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.595 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -130.93 127.57 61.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 121.174 0.512 . . . . 0.0 110.08 176.816 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.667 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -75.38 136.17 40.78 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 173.762 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.4 m-70 -107.63 28.67 7.94 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.26 0.553 . . . . 0.0 111.429 -176.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.3 mm -107.95 -54.91 5.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 171.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.49 ' O ' ' HB2' ' A' ' 34' ' ' LYS . 59.3 m-80 -95.13 -28.51 15.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.835 177.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.667 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.1 OUTLIER 79.49 53.21 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.237 174.12 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.38 131.76 54.77 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.448 174.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.55 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -96.5 125.81 41.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.852 -178.271 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.515 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 2.7 t -125.77 138.17 53.84 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.928 0.394 . . . . 0.0 110.104 175.177 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -89.16 -8.18 54.19 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.531 178.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.452 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -112.51 157.51 21.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.39 179.186 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.619 ' OD1' ' HB2' ' A' ' 42' ' ' ARG . 12.2 t70 -68.12 131.63 92.11 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.6 -177.091 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.545 ' O ' ' HB2' ' A' ' 45' ' ' PHE . 3.3 Cg_exo -77.25 5.05 5.35 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 122.928 2.418 . . . . 0.0 114.087 -175.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.619 ' HB2' ' OD1' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -76.41 -14.51 60.06 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 122.025 -0.422 . . . . 0.0 111.921 -178.369 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 mt -86.93 -82.26 0.21 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.828 0.347 . . . . 0.0 111.6 -176.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.33 -0.33 54.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.254 0.55 . . . . 0.0 112.093 -172.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.545 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 20.0 m-85 -117.51 -3.31 11.37 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.294 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.467 ' HB ' ' H ' ' A' ' 47' ' ' VAL . 0.2 OUTLIER 57.0 -114.12 0.8 Allowed 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.022 -176.463 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.467 ' H ' ' HB ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -152.95 122.37 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.831 0.348 . . . . 0.0 110.58 179.069 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -92.91 20.25 6.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.296 0.57 . . . . 0.0 110.044 176.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -105.07 -83.37 0.51 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.361 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -143.44 128.84 9.92 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.908 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -81.89 -26.29 3.08 Favored 'Trans proline' 0 CA--C 1.533 0.459 0 C-N-CA 122.866 2.377 . . . . 0.0 113.97 -175.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.7 m 65.8 86.24 0.13 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.167 0.508 . . . . 0.0 110.896 -173.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.37 126.55 35.66 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.963 -179.357 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo . . . . . 0 C--O 1.252 1.181 0 C-N-CA 122.59 2.193 . . . . 0.0 112.58 179.464 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.25 14.04 8.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.981 0.42 . . . . 0.0 111.559 -178.433 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -87.46 -67.69 0.8 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.937 0.399 . . . . 0.0 110.17 177.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -126.76 74.41 1.48 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.392 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.7 ttt-85 -75.48 100.5 4.53 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 175.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -76.63 6.11 6.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.634 -175.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.446 HH11 ' HD3' ' A' ' 7' ' ' ARG . 9.4 mtt-85 -118.33 85.11 2.29 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 174.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.36 53.31 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.1 -175.776 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.6 50.24 1.62 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.321 0.582 . . . . 0.0 110.561 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -88.05 143.82 18.35 Favored Glycine 0 N--CA 1.447 -0.603 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.498 -176.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.49 134.47 50.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.647 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.533 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 24.3 mt -85.75 152.69 57.24 Favored Pre-proline 0 C--N 1.318 -0.798 0 CA-C-O 120.926 0.393 . . . . 0.0 111.474 -176.265 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.535 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 32.6 Cg_exo -61.27 169.87 5.85 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.167 2.578 . . . . 0.0 112.515 174.456 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.59 -40.03 62.23 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.335 -0.848 . . . . 0.0 113.169 -173.493 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -83.33 -12.3 78.93 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.39 -0.909 . . . . 0.0 113.68 -175.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.615 ' HZ3' HG22 ' A' ' 37' ' ' THR . 87.6 m95 -92.27 137.97 31.92 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -172.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -120.45 141.69 49.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.542 174.249 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -92.84 104.2 16.48 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.552 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.7 mt-10 -114.67 168.63 9.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.648 -176.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.24 140.57 51.86 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.205 176.378 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.468 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -77.53 -176.56 4.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.191 0.52 . . . . 0.0 110.349 179.846 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.7 -26.37 66.14 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.427 -176.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.468 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 16.6 m-80 -84.44 -43.16 14.91 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.083 0.468 . . . . 0.0 110.842 -178.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 131.2 16.5 1.54 Allowed Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.906 -0.664 . . . . 0.0 111.854 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.0 126.96 35.64 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 174.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -80.05 152.1 4.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.352 0.596 . . . . 0.0 110.849 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.552 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 54.1 p90 -157.63 166.03 33.94 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.704 -178.092 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.406 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 7.7 m-85 -118.34 134.96 54.61 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.703 -179.061 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.549 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -129.45 124.94 60.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-O 121.138 0.494 . . . . 0.0 111.0 -179.828 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.611 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 2.6 t0 -73.56 114.06 11.38 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 171.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -86.99 0.27 55.45 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.749 -0.38 . . . . 0.0 112.012 -172.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -79.42 -49.51 19.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -101.16 -11.39 19.59 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.279 -178.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.67 58.98 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.181 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.611 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -122.29 125.68 46.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.689 179.27 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -96.93 129.35 44.39 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.001 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.615 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 7.1 t -125.51 132.22 52.67 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 172.263 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -93.02 0.05 57.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.453 0.644 . . . . 0.0 109.998 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.869 HD21 ' HG ' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -116.65 159.53 22.06 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.26 173.44 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.644 ' OD1' ' HB2' ' A' ' 42' ' ' ARG . 16.1 t70 -69.59 131.47 89.78 Favored Pre-proline 0 C--N 1.319 -0.731 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.653 -174.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.664 ' HA ' ' CD1' ' A' ' 45' ' ' PHE . 8.0 Cg_exo -74.79 29.83 0.35 Allowed 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 123.335 2.69 . . . . 0.0 114.021 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.644 ' HB2' ' OD1' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -105.59 -21.94 13.09 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 122.325 -0.234 . . . . 0.0 110.883 174.614 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.869 ' HG ' HD21 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -66.7 -93.24 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.837 -174.304 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.1 8.76 16.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.233 0.54 . . . . 0.0 111.187 -175.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.664 ' CD1' ' HA ' ' A' ' 41' ' ' PRO . 15.4 m-85 -104.21 1.97 31.19 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.86 -177.707 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.644 HG22 ' H ' ' A' ' 48' ' ' ASP . 23.8 m -138.61 135.91 35.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.943 178.508 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 35.9 m -99.35 15.45 4.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.971 0.415 . . . . 0.0 111.276 -177.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.644 ' H ' HG22 ' A' ' 46' ' ' THR . 32.9 t0 -130.65 165.74 22.18 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.274 -178.434 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -66.62 -34.95 79.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.464 0.649 . . . . 0.0 109.77 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -133.8 118.26 14.35 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.753 176.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.401 ' HG3' ' HG3' ' A' ' 42' ' ' ARG . 13.8 Cg_endo -59.01 142.54 99.51 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.563 2.175 . . . . 0.0 111.901 177.495 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.51 108.29 1.62 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.347 -177.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.2 tttm -108.87 130.26 22.94 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.853 -178.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo . . . . . 0 C--O 1.251 1.136 0 C-N-CA 123.112 2.541 . . . . 0.0 111.835 176.777 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 N-CA-C 111.742 -0.543 . . . . 0.0 111.742 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.87 -42.13 61.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.948 0.404 . . . . 0.0 110.87 -177.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.41 132.63 40.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.446 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.8 mttp -123.1 77.65 1.49 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.212 0.53 . . . . 0.0 110.01 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 8.9 mtm180 -77.82 147.13 35.36 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.442 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -92.98 7.68 43.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.51 -176.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.95 46.64 0.64 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.531 177.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -143.22 156.61 17.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.295 174.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.09 -69.48 0.5 Allowed 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.431 -175.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.15 -49.83 3.84 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.709 -178.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -63.73 -44.91 92.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.276 0.56 . . . . 0.0 109.612 173.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.403 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 7.9 mt -87.34 160.93 47.35 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.272 176.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.55 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.9 Cg_exo -56.17 173.26 0.46 Allowed 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.844 2.362 . . . . 0.0 112.251 172.115 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -61.46 -39.38 90.66 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.837 -173.131 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -75.92 -24.7 68.7 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.919 -0.657 . . . . 0.0 114.062 -175.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.55 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 88.2 m95 -82.42 138.2 34.49 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -171.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.445 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -118.19 153.56 33.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.834 175.369 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -107.79 106.63 17.01 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.468 178.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.513 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.1 mt-10 -110.78 178.55 4.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.436 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.19 138.13 53.62 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.477 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.525 ' OD1' ' HG3' ' A' ' 22' ' ' GLU . 0.8 OUTLIER -107.86 179.24 4.28 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 -179.056 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.525 ' HG3' ' OD1' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -26.4 -78.6 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -166.767 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -88.35 35.44 0.76 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.166 0.507 . . . . 0.0 111.915 -170.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.51 4.84 89.97 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.888 -0.672 . . . . 0.0 111.486 178.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -61.14 113.93 2.85 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.36 -0.42 . . . . 0.0 109.917 177.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.3 p -78.7 153.25 4.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.201 0.524 . . . . 0.0 110.752 -179.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.513 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 53.9 p90 -157.94 161.18 38.19 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.906 177.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.455 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 15.2 m-85 -116.97 137.13 52.42 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.089 -175.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.511 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.2 OUTLIER -129.54 121.03 52.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.342 0.591 . . . . 0.0 111.344 -178.652 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.717 ' HB3' ' HG2' ' A' ' 35' ' ' ARG . 43.0 t0 -78.31 117.22 19.34 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.722 -1.127 . . . . 0.0 108.958 177.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.445 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 73.7 m-70 -89.39 -4.07 58.19 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.815 0.34 . . . . 0.0 111.17 -176.313 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 17.7 mm -95.79 -42.79 12.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.195 0.521 . . . . 0.0 110.048 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.525 ' CB ' ' HD3' ' A' ' 35' ' ' ARG . 69.5 m-80 -98.13 -7.43 29.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.002 -179.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.01 51.59 2.8 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.404 173.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.717 ' HG2' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -125.9 142.3 51.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.679 0.276 . . . . 0.0 111.472 177.026 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.511 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -111.15 119.17 38.07 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.262 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.548 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 15.3 t -125.25 137.7 54.1 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.056 0.455 . . . . 0.0 110.891 178.576 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -91.65 3.81 54.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.898 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.92 163.92 16.84 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.832 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.511 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 2.7 t70 -70.79 122.54 87.1 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.567 -177.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.511 ' HD3' ' HA ' ' A' ' 40' ' ' ASP . 9.1 Cg_endo -89.99 32.74 0.35 Allowed 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 123.23 2.62 . . . . 0.0 112.687 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -115.99 -41.86 3.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.726 -0.216 . . . . 0.0 110.724 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 7.1 mt -55.96 -81.06 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.475 -178.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -106.12 13.28 29.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.115 0.483 . . . . 0.0 111.686 -174.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -103.86 71.75 1.07 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.887 -177.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -83.9 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.338 176.213 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.1 p -118.26 113.48 42.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 173.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -103.97 70.76 1.01 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.443 0.639 . . . . 0.0 110.852 -173.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -98.69 76.05 2.18 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.469 176.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -173.59 156.02 2.69 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -65.65 91.68 0.24 Allowed 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.147 1.898 . . . . 0.0 111.728 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.08 113.92 5.43 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.212 0.53 . . . . 0.0 111.121 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.479 ' HE3' ' HB3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -81.68 128.0 70.76 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.524 -179.815 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo . . . . . 0 C--O 1.25 1.124 0 C-N-CA 122.544 2.163 . . . . 0.0 111.603 175.947 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.729 0 N-CA-C 111.511 -0.636 . . . . 0.0 111.511 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.89 116.31 22.14 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.62 0.21 . . . . 0.0 110.461 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.62 122.4 26.47 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 176.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.3 mttt -80.51 -72.34 0.42 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.87 -176.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.0 mtt180 63.15 -86.68 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.171 0 O-C-N 123.558 0.536 . . . . 0.0 110.653 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.481 ' HA ' ' HB3' ' A' ' 9' ' ' ALA . 3.3 ptmt 49.89 22.67 0.89 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.208 1.003 . . . . 0.0 113.321 177.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.57 -58.51 3.86 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.328 0.585 . . . . 0.0 109.525 175.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.14 28.48 3.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.096 174.044 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.481 ' HB3' ' HA ' ' A' ' 6' ' ' LYS . . . -123.19 171.01 9.66 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.302 -177.601 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -75.31 154.34 45.93 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.492 -178.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -81.75 -16.3 51.52 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.227 0.537 . . . . 0.0 110.888 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.789 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 0.3 OUTLIER -88.39 165.67 27.2 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.78 -169.835 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.451 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 47.4 Cg_exo -60.6 -168.73 0.05 OUTLIER 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.826 3.017 . . . . 0.0 112.475 169.376 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.45 -45.32 72.83 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.011 -174.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -82.02 -21.96 60.19 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.64 -0.791 . . . . 0.0 113.157 -175.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.789 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 85.6 m95 -83.28 144.89 29.42 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -171.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.416 ' HB2' ' HD2' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -124.73 146.83 48.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.115 174.185 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.503 ' HB2' ' CD2' ' A' ' 12' ' ' LEU . 5.9 tt0 -100.6 100.96 11.75 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.618 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 5.0 mt-10 -108.91 168.17 9.55 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.102 0.477 . . . . 0.0 110.99 -175.455 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -114.28 137.62 51.56 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.549 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -176.14 4.92 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.097 0.475 . . . . 0.0 110.677 -179.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -70.45 -30.0 66.72 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.248 -175.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -78.34 -43.77 26.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.185 0.517 . . . . 0.0 109.764 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 128.74 25.78 0.99 Allowed Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.998 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.7 149.36 23.4 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 174.061 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.49 156.07 3.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.35 0.595 . . . . 0.0 110.653 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 46.0 p90 -161.05 163.72 31.37 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.592 178.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.689 ' CD1' HD21 ' A' ' 12' ' ' LEU . 14.3 m-85 -117.2 131.42 56.87 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.484 -176.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.642 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.46 122.04 46.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.329 0.585 . . . . 0.0 110.791 179.519 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.549 ' HA ' ' HA ' ' A' ' 16' ' ' TRP . 0.0 OUTLIER -77.83 126.62 31.12 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 172.949 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.416 ' HD2' ' HB2' ' A' ' 17' ' ' GLU . 64.5 m-70 -99.56 9.5 43.08 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.39 -174.095 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.5 mm -94.2 -49.34 12.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.093 0.473 . . . . 0.0 109.891 175.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -108.96 -1.52 18.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.648 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm 64.72 65.41 0.62 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 170.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.588 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -123.72 134.12 53.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.565 0.222 . . . . 0.0 111.094 173.856 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.642 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -112.1 118.75 36.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.664 179.413 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.499 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 1.8 t -125.98 136.84 53.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.775 0.321 . . . . 0.0 110.517 176.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -87.28 -7.23 58.08 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.062 0.458 . . . . 0.0 110.659 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.43 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -113.8 164.42 13.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.759 176.249 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.524 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 9.7 t70 -63.73 128.04 92.29 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.858 -176.704 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.524 ' HD3' ' HA ' ' A' ' 40' ' ' ASP . 6.3 Cg_exo -73.82 -13.89 24.21 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 122.774 2.316 . . . . 0.0 113.22 -174.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.8 mtm180 -87.45 12.31 12.51 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.686 -173.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.3 mt -79.11 -82.72 0.1 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.754 177.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -102.54 -0.07 32.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.122 0.487 . . . . 0.0 111.204 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -119.0 -172.2 2.25 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.361 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.7 m 60.04 54.14 4.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.685 176.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.76 84.99 2.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.012 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.19 -60.62 2.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.316 -173.245 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -128.53 176.27 7.89 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.43 -177.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.2 t30 -103.62 125.33 35.11 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 116.297 -0.411 . . . . 0.0 109.969 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -55.07 134.47 63.94 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 123.09 2.526 . . . . 0.0 112.775 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.8 134.17 54.43 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.28 177.145 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.421 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 2.1 mttm -67.87 132.12 92.38 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.78 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 2.6 Cg_exo . . . . . 0 C--O 1.248 1.021 0 C-N-CA 122.977 2.451 . . . . 0.0 111.598 176.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.822 0 N-CA-C 111.642 -0.583 . . . . 0.0 111.642 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.87 95.29 0.68 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.896 0.348 . . . . 0.0 110.143 177.258 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -82.11 51.97 1.89 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.749 -173.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.4 122.57 43.37 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 175.081 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -10.53 59.52 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.102 -174.144 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.64 -122.53 0.94 Allowed 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.389 -175.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? 53.98 37.63 27.16 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.111 0.482 . . . . 0.0 110.715 177.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.52 ' HB ' ' HG3' ' A' ' 13' ' ' PRO . 13.8 m -85.6 104.21 13.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.653 0.739 . . . . 0.0 110.418 -176.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.04 119.48 24.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.493 -175.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 111.92 -150.67 18.1 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.429 176.497 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.406 ' HB3' ' H ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -88.11 -87.54 0.15 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 175.765 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.474 HD11 ' HB2' ' A' ' 18' ' ' GLN . 14.5 mt -86.67 135.0 36.42 Favored Pre-proline 0 N--CA 1.427 -1.596 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 169.014 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.535 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 26.9 Cg_exo -63.15 168.26 11.16 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.479 2.119 . . . . 0.0 112.065 178.682 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.53 -39.45 80.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.688 -174.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -80.22 -20.79 66.39 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.553 -0.832 . . . . 0.0 113.047 -176.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.535 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 79.8 m95 -86.24 138.95 31.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.402 0.62 . . . . 0.0 112.36 -176.362 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -122.8 143.59 49.74 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.011 175.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.474 ' HB2' HD11 ' A' ' 12' ' ' LEU . 7.5 tt0 -93.42 110.55 22.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.074 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.657 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 2.3 mt-10 -119.92 165.28 14.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.515 -178.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.3 m -121.61 133.89 55.0 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.573 177.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.77 -177.8 6.81 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.255 0.55 . . . . 0.0 111.075 -176.633 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.97 -18.06 62.02 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.931 -174.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -88.5 -8.36 54.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.339 0.59 . . . . 0.0 109.563 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.1 19.05 58.24 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.06 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -97.44 135.63 39.03 Favored 'General case' 0 N--CA 1.438 -1.038 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 176.194 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.0 p -78.47 151.01 5.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.717 0.77 . . . . 0.0 111.084 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.657 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 50.8 p90 -150.84 160.85 43.61 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.135 177.363 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -116.55 137.93 51.8 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.571 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.53 126.52 55.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 CA-C-O 121.294 0.568 . . . . 0.0 111.492 -179.079 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.561 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 4.8 t70 -77.33 123.61 26.73 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.914 -1.039 . . . . 0.0 108.46 172.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 73.1 m-70 -98.73 9.11 44.06 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.322 -175.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 13.6 mm -91.27 -57.03 4.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.911 178.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.61 1.5 19.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.177 178.403 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 12.2 mptt 67.03 72.47 0.36 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.317 -0.856 . . . . 0.0 113.084 168.381 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.2 OUTLIER -123.84 120.31 32.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.573 172.172 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.571 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -97.57 117.1 31.07 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.235 176.309 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.524 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 2.7 t -125.63 131.9 52.58 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.856 0.36 . . . . 0.0 110.761 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -79.87 -15.7 56.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.373 0.606 . . . . 0.0 109.699 178.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.47 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER -102.52 161.5 13.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.834 -178.992 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.601 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 55.5 t0 -75.96 118.24 69.71 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.349 -175.114 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -90.66 20.84 0.92 Allowed 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.774 2.316 . . . . 0.0 112.443 176.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.53 HH11 ' HB3' ' A' ' 42' ' ' ARG . 1.3 ttp-105 -115.92 -8.25 11.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.544 175.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.601 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 27.8 mt -51.47 -72.62 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.892 -0.594 . . . . 0.0 112.037 -176.265 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -104.81 31.52 4.72 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.415 0.626 . . . . 0.0 110.663 -178.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -109.23 -78.32 0.59 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.483 -177.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.401 ' HB ' ' CG2' ' A' ' 8' ' ' VAL . 3.5 m -142.23 97.58 3.15 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.573 178.391 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 3.4 p -107.86 0.75 9.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.242 0.544 . . . . 0.0 110.147 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -91.46 7.74 39.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.372 -177.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.7 t70 73.3 -57.99 0.61 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.622 0.769 . . . . 0.0 112.362 173.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 58.11 70.34 1.28 Allowed Pre-proline 0 N--CA 1.468 0.436 0 C-N-CA 122.657 0.383 . . . . 0.0 111.069 -179.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -84.3 -12.86 7.76 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.853 2.368 . . . . 0.0 112.825 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.97 160.54 29.08 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.943 -174.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.4 ttpm? -128.6 78.86 75.28 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.292 174.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo . . . . . 0 C--O 1.247 0.949 0 C-N-CA 123.171 2.581 . . . . 0.0 112.494 -177.096 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.649 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -91.12 -17.36 26.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.03 0.443 . . . . 0.0 110.323 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -69.52 104.93 2.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.204 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.31 -79.96 0.37 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.182 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 73.0 -49.65 0.7 Allowed 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.49 0.716 . . . . 0.0 112.347 173.065 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.32 108.49 3.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.222 0.534 . . . . 0.0 111.811 -175.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.43 ' NH2' ' HB2' ' A' ' 11' ' ' ASP . 0.4 OUTLIER -84.05 65.82 8.91 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.941 177.305 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 1.4 p -78.48 -44.58 26.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.875 -175.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -145.55 177.99 8.45 Favored 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 110.383 -0.229 . . . . 0.0 110.383 -177.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.28 131.55 52.11 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.696 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.43 ' HB2' ' NH2' ' A' ' 7' ' ' ARG . 1.6 t70 -98.12 179.64 4.69 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.117 0.485 . . . . 0.0 110.436 -178.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.407 HD11 ' CD1' ' A' ' 28' ' ' PHE . 0.8 OUTLIER -97.45 169.08 9.1 Favored Pre-proline 0 C--N 1.314 -0.962 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.615 -175.509 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.502 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 72.9 Cg_exo -54.75 173.65 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 123.17 2.58 . . . . 0.0 112.551 170.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -65.15 -39.84 93.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.196 -174.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.15 -28.82 73.21 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.398 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.544 ' HZ3' HG22 ' A' ' 37' ' ' THR . 89.6 m95 -83.66 122.0 28.03 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.935 0.716 . . . . 0.0 112.935 -174.271 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -101.87 130.51 48.36 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.009 174.131 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.467 HE21 HG21 ' A' ' 26' ' ' VAL . 54.4 tt0 -85.01 100.19 11.5 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.039 0.447 . . . . 0.0 110.191 177.359 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.606 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 2.0 mm-40 -106.91 173.62 6.24 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.732 -176.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 8.0 m -126.39 139.45 53.26 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.241 175.326 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.473 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -83.74 177.51 8.33 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.17 0.51 . . . . 0.0 110.296 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.503 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -70.71 -23.69 62.51 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.368 -174.978 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.473 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 41.1 m-80 -83.96 -11.28 57.08 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.241 0.543 . . . . 0.0 110.39 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 95.48 12.51 53.82 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.473 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -81.57 139.56 35.0 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 174.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.467 HG21 HE21 ' A' ' 18' ' ' GLN . 0.8 OUTLIER -86.45 149.37 4.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.854 176.819 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.431 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 44.1 p90 -157.54 158.13 35.08 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.095 -0.957 . . . . 0.0 109.984 -179.154 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.407 ' CD1' HD11 ' A' ' 12' ' ' LEU . 10.5 m-85 -114.97 131.98 56.73 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.205 -175.24 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.612 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -129.35 120.53 51.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-O 121.614 0.721 . . . . 0.0 111.113 178.532 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.41 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 38.2 t0 -73.01 120.72 19.03 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.545 173.652 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -93.75 1.38 56.53 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.897 0.38 . . . . 0.0 110.463 -178.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.2 mm -101.81 -51.92 8.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.382 0.611 . . . . 0.0 109.632 175.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -89.11 -11.18 44.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.725 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.411 ' HD2' ' HA ' ' A' ' 34' ' ' LYS . 2.6 mmmm 62.64 57.08 1.87 Allowed 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.266 0.626 . . . . 0.0 112.564 175.455 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.57 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -124.57 125.68 44.57 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.303 175.638 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.612 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -102.08 115.64 30.98 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 174.562 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.544 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 1.6 t -126.09 134.44 51.37 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.803 0.335 . . . . 0.0 110.581 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -84.2 -4.38 58.78 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.04 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -121.61 166.7 13.83 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.96 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -68.91 125.39 91.88 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.901 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.63 ' O ' HD23 ' A' ' 43' ' ' LEU . 85.3 Cg_endo -90.78 -144.68 0.02 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.832 0 C-N-CA 122.513 2.142 . . . . 0.0 110.572 173.396 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.484 ' H ' ' HB2' ' A' ' 41' ' ' PRO . 0.0 OUTLIER 64.56 -22.05 0.07 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 179.708 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.63 HD23 ' O ' ' A' ' 41' ' ' PRO . 0.3 OUTLIER -60.81 -89.42 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.2 0.524 . . . . 0.0 111.392 -179.312 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -105.03 4.98 32.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.665 0.745 . . . . 0.0 110.674 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.449 ' CD2' ' HA ' ' A' ' 41' ' ' PRO . 0.0 OUTLIER -117.51 39.48 3.3 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.859 -177.965 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.51 -61.52 1.95 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.074 -0.966 . . . . 0.0 112.135 -175.334 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 4.6 p -94.24 75.55 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.689 0.757 . . . . 0.0 111.686 -172.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.0 t70 68.39 -73.35 0.09 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 114.627 -1.17 . . . . 0.0 113.545 169.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -69.55 126.64 30.34 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -164.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -174.23 133.99 0.56 Allowed Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 114.241 -1.345 . . . . 0.0 108.133 173.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -43.07 102.02 0.04 OUTLIER 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.737 2.958 . . . . 0.0 112.999 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.66 85.08 2.11 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.202 -178.684 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.0 107.82 47.33 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.798 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo . . . . . 0 C--O 1.25 1.084 0 C-N-CA 122.985 2.456 . . . . 0.0 111.26 176.961 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.851 0 N-CA-C 111.997 -0.441 . . . . 0.0 111.997 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 m -80.8 65.86 6.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.01 0.433 . . . . 0.0 111.381 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.39 64.27 8.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.551 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -128.9 63.66 1.47 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.663 179.751 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 71.68 136.97 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 O-C-N 123.928 0.767 . . . . 0.0 110.837 -175.35 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.6 mtmt -120.33 161.47 21.09 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.567 -176.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.7 ttm-85 64.01 46.75 3.64 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.765 -179.433 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.97 49.76 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.073 -179.699 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 76.1 156.01 0.17 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.445 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -156.9 74.04 0.23 Allowed Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.12 -14.48 57.66 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.012 0.434 . . . . 0.0 111.673 -174.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 19.9 mt -83.61 156.12 65.26 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.025 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.553 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 51.0 Cg_exo -57.28 168.33 2.86 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 122.911 2.408 . . . . 0.0 112.312 174.093 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.86 -39.23 68.41 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.736 -0.665 . . . . 0.0 112.212 -174.161 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -77.98 -22.73 68.08 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.4 -176.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.553 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 92.0 m95 -88.41 131.0 35.03 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -173.466 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.415 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 15.7 mm-40 -112.61 140.06 47.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.34 174.306 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -93.27 104.16 16.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.028 0.442 . . . . 0.0 110.164 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.618 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 4.1 mt-10 -109.81 168.45 9.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.713 -177.401 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.8 m -125.63 134.02 52.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.127 175.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.412 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -79.13 -176.51 5.16 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.188 0.518 . . . . 0.0 110.865 -177.56 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.467 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 1.0 OUTLIER -67.42 -32.41 73.27 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.472 -177.42 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.412 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 31.3 m-80 -77.75 -23.58 49.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.265 0.555 . . . . 0.0 110.276 -178.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 104.26 14.88 23.09 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.512 -178.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -84.76 137.95 32.9 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 174.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.1 p -84.88 153.96 3.58 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-O 121.476 0.655 . . . . 0.0 110.229 177.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 50.0 p90 -160.19 161.65 33.64 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.47 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.449 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 12.5 m-85 -119.38 135.99 54.48 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.388 -176.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.527 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.1 121.97 50.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.691 179.871 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.825 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 7.0 t0 -75.1 118.61 18.24 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 171.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.415 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 28.0 m-70 -87.52 -4.22 58.98 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -171.54 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.4 mt -86.96 -42.79 15.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.947 0.403 . . . . 0.0 110.378 176.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.4 m-80 -101.95 -5.74 24.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.077 179.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.44 58.94 3.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.06 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.825 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 1.3 ptt180 -121.57 121.01 36.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.745 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.527 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -101.78 120.71 40.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.928 -178.813 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.463 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 1.6 t -126.11 137.83 53.63 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.693 0.282 . . . . 0.0 110.486 175.575 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -89.15 -3.83 58.48 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.21 0.528 . . . . 0.0 109.976 177.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.411 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -106.17 156.85 18.03 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.989 175.887 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.415 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 5.5 t0 -78.13 121.09 83.47 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.213 -175.54 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.486 ' HA ' ' CD2' ' A' ' 45' ' ' PHE . 1.9 Cg_endo -81.67 53.74 4.78 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.259 2.639 . . . . 0.0 111.969 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.54 -44.8 2.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.524 -177.397 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.777 ' H ' HD22 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -58.55 -76.94 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.907 0.384 . . . . 0.0 111.992 -175.713 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -102.69 11.53 37.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.038 0.447 . . . . 0.0 111.371 -177.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.486 ' CD2' ' HA ' ' A' ' 41' ' ' PRO . 49.0 m-85 -118.42 133.75 55.62 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.355 -176.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.439 ' HB ' ' H ' ' A' ' 47' ' ' VAL . 3.8 p -107.57 -124.73 0.24 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 172.14 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.439 ' H ' ' HB ' ' A' ' 46' ' ' THR . 0.8 OUTLIER -95.53 -9.65 9.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 165.578 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -107.68 151.87 25.08 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.019 -178.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -88.86 171.23 10.07 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.348 -174.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -102.17 125.05 37.72 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.917 178.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.84 45.06 1.56 Allowed 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 122.917 2.411 . . . . 0.0 112.786 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.54 HG22 ' HE2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER 54.59 -106.17 0.3 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.584 -179.522 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.54 ' HE2' HG22 ' A' ' 52' ' ' THR . 0.0 OUTLIER -169.25 165.55 6.51 Favored Pre-proline 0 C--N 1.328 -0.357 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 -179.106 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo . . . . . 0 C--O 1.249 1.068 0 C-N-CA 122.148 1.898 . . . . 0.0 112.168 176.069 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.828 0 N-CA-C 112.105 -0.398 . . . . 0.0 112.105 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.8 106.71 12.02 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 179.651 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.65 59.55 3.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.34 0.591 . . . . 0.0 111.041 -179.016 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.63 122.5 11.98 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.373 178.619 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.499 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 1.8 ttm105 -61.25 126.22 26.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.462 -177.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.757 ' HB3' HG23 ' A' ' 8' ' ' VAL . 18.6 mtmt 74.27 -26.8 0.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.804 0.69 . . . . 0.0 111.591 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.44 ' H ' ' C ' ' A' ' 5' ' ' ARG . 5.1 ttp180 61.98 23.98 14.21 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.1 0.56 . . . . 0.0 111.006 -178.176 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.757 HG23 ' HB3' ' A' ' 6' ' ' LYS . 85.2 t -82.13 98.38 4.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.222 0.534 . . . . 0.0 110.353 -179.487 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -95.26 -23.39 17.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.655 177.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.56 112.08 3.3 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.599 -177.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -53.48 145.21 15.2 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 121.881 0.848 . . . . 0.0 111.725 -177.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.508 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 35.3 mt -76.7 157.31 82.2 Favored Pre-proline 0 C--N 1.307 -1.256 0 CA-C-N 114.281 -1.327 . . . . 0.0 112.087 -173.205 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.511 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 31.3 Cg_exo -61.09 -172.47 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 123.357 2.704 . . . . 0.0 113.336 176.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -54.56 45.68 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.416 -172.366 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -78.23 -17.26 78.39 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.615 -0.721 . . . . 0.0 113.315 -173.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.575 ' CZ3' HG22 ' A' ' 37' ' ' THR . 92.6 m95 -85.35 133.65 34.13 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.514 0.673 . . . . 0.0 112.735 -170.739 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -120.42 135.9 54.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.578 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -85.12 109.44 18.26 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.616 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.1 mm-40 -118.35 166.99 11.98 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.421 -176.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.8 m -127.69 135.38 50.11 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.87 173.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.73 -178.23 5.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.369 0.604 . . . . 0.0 110.917 -177.173 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -32.08 73.38 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.309 -175.552 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -74.29 -41.66 60.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.436 0.636 . . . . 0.0 110.303 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 125.91 14.05 3.18 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.713 -179.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.39 127.5 34.39 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 175.664 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -79.17 151.69 4.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.348 0.594 . . . . 0.0 110.228 178.597 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.405 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.5 p90 -162.09 160.61 27.57 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.518 -178.063 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.413 ' CD1' HD11 ' A' ' 12' ' ' LEU . 3.2 m-85 -115.25 135.62 53.96 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.828 -179.3 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.616 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -125.68 129.29 72.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.424 0.63 . . . . 0.0 110.981 177.729 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.522 ' HB3' ' CG ' ' A' ' 35' ' ' ARG . 5.2 t0 -77.76 109.76 12.03 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.638 -1.165 . . . . 0.0 108.404 174.312 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -85.35 9.24 16.01 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.457 -174.088 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -94.76 -52.63 9.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.902 0.382 . . . . 0.0 110.082 174.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -103.55 -1.43 28.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.233 -178.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.8 mmtp 63.87 61.17 0.98 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.125 0.57 . . . . 0.0 111.981 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.522 ' CG ' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -123.97 135.93 53.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.896 176.886 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -107.13 123.68 48.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.006 -179.322 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.575 HG22 ' CZ3' ' A' ' 16' ' ' TRP . 6.8 t -126.53 135.77 51.72 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.943 0.401 . . . . 0.0 110.512 173.122 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -88.55 -1.52 58.1 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.99 0.424 . . . . 0.0 110.512 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.687 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -122.42 165.64 16.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.142 178.326 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.687 ' H ' HD13 ' A' ' 39' ' ' LEU . 8.3 t70 -64.65 130.05 94.57 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.741 -179.053 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.499 ' HD3' ' HA ' ' A' ' 40' ' ' ASP . 2.3 Cg_endo -82.95 3.77 7.59 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.252 2.635 . . . . 0.0 114.726 -172.335 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.8 mtt85 -80.46 -11.03 59.73 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.904 -0.497 . . . . 0.0 111.265 -177.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 mt -86.08 -88.54 0.12 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.383 -177.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -105.99 8.39 32.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.76 0.314 . . . . 0.0 111.692 -174.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.496 ' CD2' ' HA ' ' A' ' 41' ' ' PRO . 13.5 m-85 -112.7 21.22 15.79 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.42 0.628 . . . . 0.0 110.866 -174.607 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.95 -45.96 3.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.807 177.367 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.4 p -118.02 127.2 75.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.231 178.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.8 t0 73.55 -39.67 0.44 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.863 0.865 . . . . 0.0 111.947 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.443 ' OD2' ' HD2' ' A' ' 51' ' ' PRO . 4.1 t70 68.41 -167.24 0.19 Allowed 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.815 0.446 . . . . 0.0 111.207 176.447 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.66 ' HB3' ' HD3' ' A' ' 51' ' ' PRO . 4.5 t-20 -152.68 -55.25 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.658 -178.288 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.66 ' HD3' ' HB3' ' A' ' 50' ' ' ASN . 47.0 Cg_exo -58.61 -38.83 87.59 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 121.878 1.719 . . . . 0.0 111.142 171.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.58 46.97 0.92 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.492 178.322 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.613 ' N ' ' HD2' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -73.61 -45.49 7.31 Favored Pre-proline 0 CA--C 1.537 0.472 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.862 177.424 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.613 ' HD2' ' N ' ' A' ' 53' ' ' LYS . 12.2 Cg_endo . . . . . 0 C--O 1.252 1.186 0 C-N-CA 121.981 1.787 . . . . 0.0 112.065 177.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.662 0 N-CA-C 111.681 -0.568 . . . . 0.0 111.681 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.21 -40.92 86.51 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.742 0.306 . . . . 0.0 111.635 -177.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -151.55 84.46 1.3 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.86 0.362 . . . . 0.0 111.301 -176.182 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -83.98 37.79 0.62 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.189 0.518 . . . . 0.0 110.533 177.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -127.76 -150.13 0.43 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.023 -177.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 66.28 51.66 1.2 Allowed 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.196 0.522 . . . . 0.0 111.683 176.434 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.477 ' HB3' ' H ' ' A' ' 8' ' ' VAL . 0.1 OUTLIER -122.35 -95.08 0.49 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 172.098 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.477 ' H ' ' HB3' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -151.67 129.79 2.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.759 176.575 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -142.11 72.33 1.38 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.053 0.454 . . . . 0.0 110.88 179.033 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -69.36 -47.92 48.36 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 110.784 -0.926 . . . . 0.0 110.784 176.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -106.72 -92.79 0.39 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 172.558 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.5 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 16.0 mt -103.17 156.36 35.47 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 174.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.54 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 39.6 Cg_exo -59.62 163.37 13.26 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.332 2.021 . . . . 0.0 111.499 169.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -56.42 -38.64 71.84 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -173.439 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.7 -23.67 76.65 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 121.123 -0.561 . . . . 0.0 113.421 -178.173 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.571 ' HZ3' HG22 ' A' ' 37' ' ' THR . 87.3 m95 -85.66 129.33 34.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.328 0.585 . . . . 0.0 112.366 -174.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -110.23 139.8 45.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.329 171.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -95.22 107.83 19.94 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.584 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.5 mm-40 -113.47 167.79 10.29 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.932 -174.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.4 m -116.23 140.07 49.69 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 177.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -179.04 7.24 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.026 0.441 . . . . 0.0 110.727 -179.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.459 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -61.74 -32.83 73.1 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.718 -177.36 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -82.53 -43.8 16.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.781 -177.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 136.38 5.81 1.98 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 121.165 -0.541 . . . . 0.0 111.753 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.49 137.8 38.12 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 176.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.5 p -88.92 152.2 3.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.419 0.628 . . . . 0.0 110.642 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.519 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 45.5 p90 -154.53 161.92 41.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.79 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.449 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 13.0 m-85 -115.64 133.06 56.4 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.862 -176.256 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.604 ' HA ' ' O ' ' A' ' 35' ' ' ARG . 0.1 OUTLIER -131.42 119.92 44.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.316 0.579 . . . . 0.0 111.234 179.792 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.615 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 5.6 t0 -78.03 110.37 12.91 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 171.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -81.67 -8.12 59.67 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.035 -173.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.6 mm -77.96 -55.96 8.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.249 178.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -99.03 -0.03 42.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.357 -177.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? 68.6 60.46 0.37 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.861 173.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.615 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -122.71 119.79 31.73 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.286 177.902 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.559 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -107.75 112.79 25.64 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.055 177.389 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.571 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 3.4 t -126.24 130.89 51.81 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.064 0.459 . . . . 0.0 110.908 179.436 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -82.34 -10.4 59.1 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.591 179.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.17 162.42 14.96 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.061 178.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.499 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 10.4 t0 -63.81 123.16 80.69 Favored Pre-proline 0 C--N 1.324 -0.538 0 O-C-N 123.635 0.584 . . . . 0.0 110.94 -176.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.499 ' HD3' ' HA ' ' A' ' 40' ' ' ASP . 23.3 Cg_exo -64.52 -22.31 65.29 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 123.371 2.714 . . . . 0.0 113.325 -175.207 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 42' ' ' ARG . 0.2 OUTLIER -79.56 -7.31 58.41 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.566 0.21 . . . . 0.0 111.566 -174.493 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.87 -93.87 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.027 0.442 . . . . 0.0 112.07 -178.035 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -105.85 1.38 26.8 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -174.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.418 ' CD2' ' HA ' ' A' ' 41' ' ' PRO . 9.1 m-85 -97.02 -17.82 19.79 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.356 -172.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.4 167.67 10.69 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.062 179.218 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 16.2 m -96.32 -14.28 7.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 171.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.1 t70 57.56 -157.71 0.29 Allowed 'General case' 0 C--O 1.233 0.228 0 CA-C-N 114.605 -1.18 . . . . 0.0 111.787 178.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -133.9 -18.31 2.11 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.047 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -113.55 115.77 46.54 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.971 178.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -78.11 157.58 30.29 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 122.511 2.141 . . . . 0.0 112.538 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -72.62 0.23 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.909 176.282 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.732 ' HB2' ' HD3' ' A' ' 54' ' ' PRO . 19.2 mmtp -140.82 -51.23 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.406 175.229 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.732 ' HD3' ' HB2' ' A' ' 53' ' ' LYS . 5.0 Cg_exo . . . . . 0 C--O 1.248 0.991 0 C-N-CA 122.39 2.06 . . . . 0.0 111.217 171.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.683 0 N-CA-C 111.785 -0.526 . . . . 0.0 111.785 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -146.61 154.03 41.02 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 -178.872 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -77.36 143.68 38.54 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 177.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.37 -66.32 1.09 Allowed 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.494 -175.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.84 98.15 1.2 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -174.416 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -107.26 111.36 23.7 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 170.727 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.81 62.24 6.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.309 -175.542 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.2 t -102.19 -74.56 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.243 -0.435 . . . . 0.0 109.936 177.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -116.89 123.63 47.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.725 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.28 54.87 3.03 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.887 -0.673 . . . . 0.0 113.033 177.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -71.31 -49.8 38.99 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 174.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.423 ' HA ' ' NH1' ' A' ' 42' ' ' ARG . 0.8 OUTLIER -81.16 170.69 14.48 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.415 175.44 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.575 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 51.3 Cg_exo -56.8 165.67 4.6 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.247 1.965 . . . . 0.0 111.278 170.802 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -61.58 -38.28 86.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.658 -171.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.63 -25.19 75.79 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.161 -0.542 . . . . 0.0 113.548 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.575 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 86.3 m95 -83.78 144.14 29.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.515 0.674 . . . . 0.0 112.676 -174.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.54 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 2.0 mt-10 -127.29 149.31 50.08 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.095 174.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -96.88 102.89 14.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.697 177.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.507 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.6 mt-10 -105.48 178.86 4.44 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.989 0.423 . . . . 0.0 110.424 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.8 m -131.5 139.58 49.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.325 176.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.401 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -78.52 176.64 9.22 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.338 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.477 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 2.4 pt-20 -67.29 -26.34 66.49 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.771 -174.163 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.401 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 35.6 m-80 -84.9 -35.11 22.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.963 0.411 . . . . 0.0 110.219 -179.354 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 126.15 15.09 2.87 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.216 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -83.52 142.52 30.84 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 174.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -90.97 154.94 3.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.303 0.573 . . . . 0.0 110.507 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.438 ' CB ' ' HA ' ' A' ' 38' ' ' TYR . 50.6 p90 -161.96 161.08 28.47 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.264 178.53 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -116.88 139.96 50.01 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.045 -176.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.547 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.77 123.68 52.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.218 0.532 . . . . 0.0 111.515 -177.916 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -73.03 114.62 11.39 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 170.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.54 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 50.3 m-70 -84.98 -4.13 59.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.789 0.328 . . . . 0.0 111.375 -175.406 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.5 mm -95.97 -49.78 12.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.4 0.619 . . . . 0.0 109.952 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -98.43 -5.89 31.6 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.04 -177.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.16 56.32 1.77 Allowed 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 175.261 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.516 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -119.13 120.68 37.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.738 177.896 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.547 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -105.0 116.2 31.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.312 179.331 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.413 HG22 ' CZ3' ' A' ' 16' ' ' TRP . 1.2 t -126.05 132.29 51.99 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.673 0.273 . . . . 0.0 110.429 177.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.438 ' HA ' ' CB ' ' A' ' 27' ' ' PHE . 8.2 m-85 -72.87 -25.52 61.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.019 0.438 . . . . 0.0 111.104 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.777 ' HB3' ' HE2' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -106.33 170.4 7.95 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.629 178.513 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -74.71 120.66 82.63 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.594 -175.272 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.743 ' HA ' ' HB2' ' A' ' 45' ' ' PHE . 45.0 Cg_endo -75.02 3.68 5.41 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 122.802 2.335 . . . . 0.0 113.349 -176.275 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.423 ' NH1' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -84.87 -6.74 59.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.798 0.333 . . . . 0.0 110.883 178.424 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 69.9 mt -91.85 -101.9 0.11 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.112 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -97.49 4.64 50.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.87 0.366 . . . . 0.0 111.855 -175.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.777 ' HE2' ' HB3' ' A' ' 39' ' ' LEU . 25.5 m-85 -100.44 -0.54 37.88 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.414 -175.379 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.99 144.5 26.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.957 -179.642 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 12.6 t -68.3 97.65 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.437 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.23 -55.15 0.31 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.499 -0.773 . . . . 0.0 108.928 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -98.34 171.77 7.98 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 168.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -87.58 116.57 66.57 Favored Pre-proline 0 C--N 1.313 -0.991 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 176.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -48.76 118.93 3.76 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.994 2.463 . . . . 0.0 112.489 -176.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.1 41.45 0.52 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.216 0.531 . . . . 0.0 111.55 -177.55 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt -134.63 81.23 48.35 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 176.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo . . . . . 0 C--O 1.251 1.148 0 C-N-CA 123.221 2.614 . . . . 0.0 112.568 -173.704 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.812 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -131.48 -62.65 0.87 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.621 0.248 . . . . 0.0 110.78 -177.053 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -73.8 123.24 23.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.982 -178.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.59 136.2 36.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.041 -178.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.62 63.4 1.6 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.363 176.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER 50.24 54.46 11.08 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.545 -174.111 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.9 mtm-85 -83.65 68.07 9.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.736 -170.587 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 33.0 m -81.53 -18.31 11.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 170.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 65.79 55.74 0.95 Allowed 'General case' 0 C--O 1.234 0.259 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.923 174.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.18 82.39 1.67 Allowed Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 110.103 -1.199 . . . . 0.0 110.103 170.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.12 -171.94 1.87 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.326 0.584 . . . . 0.0 111.351 -171.467 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.617 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 15.9 mt -86.33 151.09 53.17 Favored Pre-proline 0 C--N 1.317 -0.808 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.463 -174.63 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.451 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 46.4 Cg_exo -59.25 175.82 0.65 Allowed 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.382 2.722 . . . . 0.0 111.704 170.248 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -64.53 -40.1 94.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.258 -173.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.1 -29.28 73.32 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.828 -0.701 . . . . 0.0 113.021 -178.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.617 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 92.0 m95 -82.44 132.5 35.21 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -173.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.407 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -115.31 142.24 46.95 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.852 174.758 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -91.22 102.77 15.49 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 176.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.665 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.6 mm-40 -110.57 168.82 9.18 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.296 0.57 . . . . 0.0 111.069 -175.421 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.1 m -122.99 135.15 54.36 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.661 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.52 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -83.07 -179.1 7.34 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.415 179.567 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.472 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 1.6 pt-20 -72.61 -15.98 61.73 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.515 -175.001 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.52 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 38.5 m-80 -88.31 -10.66 48.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.909 0.385 . . . . 0.0 110.314 177.263 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.17 17.22 57.94 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.787 -177.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -91.92 144.56 25.34 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -88.15 156.24 3.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.349 0.595 . . . . 0.0 110.81 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.453 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.5 p90 -162.21 160.61 27.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.096 177.249 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.462 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 13.8 m-85 -116.82 135.28 53.86 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.219 -176.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.824 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.4 124.09 54.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 120.904 0.383 . . . . 0.0 110.825 179.704 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.546 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 1.4 t0 -76.78 131.64 38.82 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 170.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.407 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 70.8 m-70 -97.9 -0.75 44.37 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 121.003 -0.279 . . . . 0.0 111.651 -172.54 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.8 mt -92.58 -55.29 6.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.896 177.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -95.53 -14.96 23.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.748 0.308 . . . . 0.0 110.18 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 2.0 mmtt 70.58 71.76 0.2 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.98 176.522 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.578 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.6 mtp180 -122.38 119.12 30.1 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.24 174.392 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.824 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -104.01 114.09 28.09 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.469 178.833 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.31 138.59 53.08 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.666 0.269 . . . . 0.0 111.134 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -78.42 -14.65 59.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.848 0.356 . . . . 0.0 110.857 175.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.503 HD22 ' HA ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -102.86 155.57 18.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.497 -178.386 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.507 ' OD2' ' HG ' ' A' ' 43' ' ' LEU . 5.2 t0 -73.02 121.87 86.21 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.199 -175.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.512 ' HA ' ' HB2' ' A' ' 45' ' ' PHE . 17.0 Cg_exo -67.77 -8.93 23.91 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 123.327 2.685 . . . . 0.0 112.817 -179.669 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.647 ' HA ' HH11 ' A' ' 42' ' ' ARG . 0.0 OUTLIER -90.82 -11.27 39.88 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.909 178.594 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.507 ' HG ' ' OD2' ' A' ' 40' ' ' ASP . 67.1 mt -82.61 -91.16 0.07 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.706 0.288 . . . . 0.0 111.466 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -105.55 13.23 30.32 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -173.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.512 ' HB2' ' HA ' ' A' ' 41' ' ' PRO . 43.7 m-85 -94.42 24.52 4.45 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.308 0.575 . . . . 0.0 110.599 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -46.64 72.29 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.581 176.394 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.59 140.68 28.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.202 179.039 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -73.0 90.96 1.52 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.798 177.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.6 t70 59.3 -113.22 0.64 Allowed 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.737 -175.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -164.79 125.81 1.4 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-O 120.583 0.23 . . . . 0.0 110.679 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -73.34 -13.32 25.43 Favored 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 122.786 2.324 . . . . 0.0 112.453 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.5 m -81.21 72.69 8.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.19 0.519 . . . . 0.0 110.522 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.8 mtmt -160.5 154.69 19.67 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.407 179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo . . . . . 0 C--O 1.25 1.075 0 C-N-CA 122.492 2.128 . . . . 0.0 111.994 176.466 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 34.6 mt . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.684 0.278 . . . . 0.0 111.353 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.473 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 23.6 Cg_exo -65.61 159.38 48.44 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.87 2.38 . . . . 0.0 111.396 173.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.5 137.23 36.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 121.125 0.488 . . . . 0.0 110.128 171.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.56 -43.06 1.76 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.484 -175.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.473 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 95.2 m95 -75.94 132.87 40.52 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.943 0.719 . . . . 0.0 112.943 -175.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -114.09 142.87 45.66 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.722 174.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -97.4 117.1 30.89 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.3 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -127.41 174.54 8.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.087 0.47 . . . . 0.0 110.478 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -132.29 140.33 48.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.082 176.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.488 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -87.84 -173.81 4.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.074 0.464 . . . . 0.0 111.068 -178.501 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.542 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -73.56 -20.89 60.51 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.593 -176.885 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.488 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 44.0 m-80 -85.95 -6.4 59.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.098 0.475 . . . . 0.0 110.395 179.142 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.25 12.82 78.19 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.757 -178.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.49 124.59 32.98 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.9 p -73.6 145.63 11.33 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 120.048 -0.661 . . . . 0.0 110.381 178.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -148.31 159.35 44.08 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.263 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -120.51 137.77 54.19 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.091 -175.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.632 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.13 118.61 37.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-O 121.38 0.609 . . . . 0.0 110.701 -178.302 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.598 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -76.27 138.71 40.73 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.948 176.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -109.38 23.5 14.38 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.045 0.45 . . . . 0.0 111.176 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.8 mm -103.07 -53.8 7.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.483 175.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.9 -22.3 15.86 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.263 175.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.598 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 1.0 OUTLIER 77.11 62.64 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.907 172.925 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.485 ' HG3' ' OD2' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -122.49 123.58 41.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.929 0.395 . . . . 0.0 111.311 174.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.632 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -87.42 119.72 27.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.108 175.015 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.438 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 6.3 t -123.76 136.68 54.57 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.15 0.5 . . . . 0.0 110.422 178.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -89.77 11.9 18.7 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.823 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.503 HD22 ' HA ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -122.0 156.92 32.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.445 179.129 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.3 t70 . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.925 -177.829 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.468 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 4.2 mt . . . . . 0 C--O 1.235 0.297 0 CA-C-O 120.441 0.162 . . . . 0.0 110.89 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.56 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.5 Cg_exo -57.53 163.09 9.17 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.309 2.006 . . . . 0.0 111.546 170.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.81 -34.06 71.08 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.414 -172.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -75.91 -23.74 71.28 Favored Glycine 0 CA--C 1.518 0.222 0 C-N-CA 121.083 -0.579 . . . . 0.0 113.278 -178.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.56 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 85.4 m95 -86.14 147.36 26.18 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.464 0.649 . . . . 0.0 112.654 -175.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.421 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 4.2 mm-40 -125.13 138.65 54.16 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.561 173.084 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -91.29 95.3 9.95 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.629 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.4 mm-40 -104.9 166.68 10.22 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.025 -175.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.0 m -124.72 137.65 54.33 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.565 176.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.91 -178.31 6.79 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.392 0.615 . . . . 0.0 110.814 -179.014 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.508 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -69.23 -29.02 66.86 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.753 -176.7 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -75.02 -33.17 61.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.237 0.542 . . . . 0.0 109.738 178.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 113.6 21.25 5.83 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.934 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -96.5 131.95 42.57 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 174.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -78.63 151.13 5.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.504 0.668 . . . . 0.0 110.349 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.4 p90 -154.56 161.2 41.74 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.289 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.443 ' CD1' HD11 ' A' ' 12' ' ' LEU . 14.1 m-85 -116.58 131.69 56.88 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.281 -176.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.718 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -128.94 123.8 59.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.278 0.561 . . . . 0.0 110.917 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -72.91 119.71 17.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 171.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.421 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 38.3 m-70 -89.51 0.73 56.68 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.276 0.56 . . . . 0.0 111.295 -174.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 12.3 mt -105.34 -52.53 7.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.871 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.472 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 71.0 m-80 -89.09 6.29 40.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.937 -178.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 33' ' ' ASN . 0.0 OUTLIER 42.27 53.9 4.35 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.607 1.163 . . . . 0.0 113.61 177.695 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.546 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 8.7 mtp180 -116.01 124.07 49.57 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 122.182 -0.324 . . . . 0.0 110.322 176.092 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.718 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.96 112.82 26.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.405 177.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.436 HG22 ' CZ3' ' A' ' 16' ' ' TRP . 12.4 t -126.21 139.71 53.13 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 120.877 0.37 . . . . 0.0 110.827 -179.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -91.2 5.42 49.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.87 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.612 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -121.08 165.87 14.71 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.883 178.418 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.612 ' H ' HD13 ' A' ' 39' ' ' LEU . 32.8 t0 . . . . . 0 C--N 1.327 -0.399 0 O-C-N 123.4 0.438 . . . . 0.0 110.491 -178.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.659 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 0.1 OUTLIER . . . . . 0 CA--C 1.515 -0.381 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.583 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 32.4 Cg_exo -57.24 167.46 3.44 Favored 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.315 2.01 . . . . 0.0 111.187 169.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -55.94 -37.48 69.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.057 -174.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -78.42 -23.73 64.69 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.647 -0.787 . . . . 0.0 113.113 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.659 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 92.6 m95 -87.9 144.58 26.49 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -173.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.44 ' HB2' ' HD2' ' A' ' 31' ' ' HIS . 1.8 mm-40 -130.26 146.48 51.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.664 176.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.469 HE21 HG21 ' A' ' 26' ' ' VAL . 66.2 tt0 -97.43 104.38 16.39 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.985 0.422 . . . . 0.0 110.432 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.638 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.2 mt-10 -114.18 165.23 12.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.017 -178.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.43 145.37 44.18 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.933 0.397 . . . . 0.0 110.567 177.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.403 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -81.04 -177.93 6.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.975 0.416 . . . . 0.0 110.353 179.158 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.405 ' HG3' ' H ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -65.68 -28.16 68.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.668 -175.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.403 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 3.9 m-80 -85.18 -46.12 11.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.159 0.504 . . . . 0.0 110.737 -178.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.69 12.15 0.8 Allowed Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.899 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.48 133.67 34.46 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 175.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.469 HG21 HE21 ' A' ' 18' ' ' GLN . 1.5 p -86.16 153.93 3.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.428 0.632 . . . . 0.0 110.983 -178.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.638 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 54.4 p90 -155.29 163.0 40.73 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.834 -1.075 . . . . 0.0 109.263 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.608 ' CD1' HD21 ' A' ' 12' ' ' LEU . 11.4 m-85 -118.92 137.87 53.17 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.826 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.531 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -130.75 125.06 57.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 121.162 0.505 . . . . 0.0 111.269 -178.047 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.422 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 54.2 t0 -76.68 99.26 5.0 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 173.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.44 ' HD2' ' HB2' ' A' ' 17' ' ' GLU . 30.8 m-70 -75.82 -7.43 54.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.698 0.285 . . . . 0.0 111.193 -172.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 46.6 mm -63.29 -48.94 85.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.124 0.488 . . . . 0.0 110.317 176.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.69 2.47 14.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.598 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.496 ' N ' ' HE3' ' A' ' 34' ' ' LYS . 0.0 OUTLIER 60.61 62.99 1.4 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.588 176.307 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.422 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -122.84 125.34 45.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.753 0.311 . . . . 0.0 110.376 173.486 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.451 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -97.7 120.56 38.3 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.944 -178.707 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.561 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 12.8 t -126.37 139.28 53.4 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.152 0.501 . . . . 0.0 110.441 176.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -85.63 -12.05 52.37 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.368 0.604 . . . . 0.0 110.027 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.474 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -83.53 149.67 26.46 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.348 179.442 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.474 ' H ' HD13 ' A' ' 39' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.437 -1.089 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.166 -176.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.0 mt . . . . . 0 C--O 1.234 0.272 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.456 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.0 Cg_exo -58.82 174.67 0.77 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.455 2.77 . . . . 0.0 112.319 170.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -64.77 -41.09 96.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.403 -175.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.34 -25.25 75.64 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.882 -0.675 . . . . 0.0 113.256 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.456 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 92.1 m95 -87.57 142.94 27.46 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.412 0.625 . . . . 0.0 112.601 -175.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.37 154.06 34.19 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.063 174.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -105.23 101.88 11.4 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.632 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.3 mm-40 -113.17 165.52 12.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.678 -175.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.7 m -116.45 138.25 51.52 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.794 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.78 178.6 7.24 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 121.343 0.592 . . . . 0.0 110.506 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.512 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.5 OUTLIER -59.68 -39.58 84.98 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.125 -177.239 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -73.08 -49.59 27.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.778 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 139.42 10.88 0.79 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.974 -0.631 . . . . 0.0 112.033 -178.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -85.66 143.17 28.56 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.4 p -86.35 156.7 3.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.233 0.539 . . . . 0.0 111.052 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.506 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 45.9 p90 -158.85 161.91 36.91 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.608 178.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -116.97 132.52 56.68 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.442 -176.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.632 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -130.02 130.0 65.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.836 179.017 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.49 132.4 36.32 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 172.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.0 m-70 -100.77 15.76 27.27 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.251 -0.58 . . . . 0.0 111.666 -173.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.2 mt -99.01 -54.27 7.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.078 173.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.443 ' O ' ' HB2' ' A' ' 34' ' ' LYS . 2.7 m-80 -95.15 -15.97 22.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.249 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 33' ' ' ASN . 0.4 OUTLIER 74.31 39.49 0.47 Allowed 'General case' 0 N--CA 1.464 0.271 0 O-C-N 124.191 0.932 . . . . 0.0 111.529 177.796 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.503 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 58.5 mtp180 -89.8 136.01 33.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.86 0.362 . . . . 0.0 110.538 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -115.89 118.06 31.93 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.377 -178.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.427 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 2.3 t -125.46 131.94 52.78 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.004 0.431 . . . . 0.0 110.263 176.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -88.91 0.08 56.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.46 0.647 . . . . 0.0 109.926 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.92 163.45 15.54 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.031 176.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.3 t0 . . . . . 0 C--N 1.324 -0.542 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.715 -178.236 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 120.505 0.193 . . . . 0.0 111.318 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.525 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 72.4 Cg_exo -52.53 168.62 0.42 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.137 2.558 . . . . 0.0 112.033 168.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -64.89 -38.36 90.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.165 -173.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.73 -27.04 71.48 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.056 -0.593 . . . . 0.0 113.05 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.525 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 94.2 m95 -85.21 141.94 29.79 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -176.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -124.29 138.75 54.36 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.92 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.7 HE21 ' HE1' ' A' ' 28' ' ' PHE . 8.7 tt0 -88.08 100.6 13.06 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.265 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -100.96 172.23 7.15 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.506 -178.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 m -134.25 134.69 42.27 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.33 174.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.6 -174.28 5.19 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.527 -175.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.429 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -70.58 -31.58 68.64 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.311 -177.44 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -76.17 -25.65 55.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.36 0.6 . . . . 0.0 109.903 178.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 105.95 12.07 26.75 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.769 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.97 144.19 30.16 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 174.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.1 p -86.94 153.87 3.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-O 121.145 0.498 . . . . 0.0 110.25 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -159.41 156.69 28.87 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.171 178.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.7 ' HE1' HE21 ' A' ' 18' ' ' GLN . 11.3 m-85 -113.18 132.72 55.37 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.012 -175.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.645 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -125.41 123.54 65.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-O 121.474 0.654 . . . . 0.0 111.169 -179.145 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.622 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 12.1 t0 -77.38 133.57 38.66 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.528 172.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.4 m-70 -100.84 -2.84 31.11 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 120.711 0.291 . . . . 0.0 111.271 -174.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.2 mt -88.09 -61.72 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 120.899 0.381 . . . . 0.0 110.304 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.524 ' C ' ' HG2' ' A' ' 34' ' ' LYS . 3.1 p30 -106.91 23.25 14.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.102 0.477 . . . . 0.0 110.615 178.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.622 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.0 OUTLIER 38.1 75.38 0.07 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.799 1.24 . . . . 0.0 113.894 173.499 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.477 ' HD3' ' CH2' ' A' ' 16' ' ' TRP . 0.0 OUTLIER -122.23 119.41 31.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.715 0.293 . . . . 0.0 110.401 172.944 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.645 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -99.83 113.99 26.87 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.195 178.01 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.7 t -126.33 132.87 51.52 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.391 0.139 . . . . 0.0 110.735 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -76.6 -26.89 55.48 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.212 0.53 . . . . 0.0 110.306 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.26 168.82 8.93 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.357 -178.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 13.5 t70 . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.052 -176.901 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.59 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 42.9 Cg_exo -56.53 158.11 16.9 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 121.874 1.716 . . . . 0.0 110.911 169.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -36.73 70.01 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.101 -0.499 . . . . 0.0 112.072 -171.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.32 -30.37 75.3 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.877 -0.677 . . . . 0.0 113.249 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.638 ' HZ3' HG22 ' A' ' 37' ' ' THR . 86.6 m95 -81.39 130.38 35.02 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -173.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.426 ' OE1' ' HA ' ' A' ' 17' ' ' GLU . 4.9 mm-40 -114.25 150.98 33.55 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.015 174.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -96.7 104.62 16.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.821 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.611 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 0.8 OUTLIER -115.63 166.2 12.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.137 0.494 . . . . 0.0 110.64 -176.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.03 139.89 53.4 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.587 174.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.453 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -81.3 -179.07 7.2 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.382 0.61 . . . . 0.0 110.713 -179.273 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.33 -11.51 60.73 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.013 -173.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.453 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 29.5 m-80 -101.81 -6.32 23.75 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.056 0.455 . . . . 0.0 110.252 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 91.12 16.11 54.56 Favored Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.969 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -89.46 125.45 35.18 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 175.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 6.0 p -75.89 150.96 6.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.471 0.653 . . . . 0.0 110.992 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 41.1 p90 -156.17 158.53 37.79 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.541 -1.208 . . . . 0.0 108.76 176.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -119.01 136.59 54.04 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.507 -176.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.633 ' HA ' ' O ' ' A' ' 35' ' ' ARG . 0.2 OUTLIER -133.27 124.28 48.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.482 0.658 . . . . 0.0 111.979 -176.509 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.451 ' HB2' ' CE2' ' A' ' 16' ' ' TRP . 50.4 t0 -74.05 109.58 7.66 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.308 171.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 43.2 m-70 -82.52 -1.54 50.81 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.07 0.462 . . . . 0.0 111.101 -175.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.8 mm -97.03 -52.94 8.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.835 176.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -90.7 -5.42 55.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.159 -178.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 62.15 61.29 1.35 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.455 176.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.633 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -123.8 118.94 28.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.688 177.102 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.526 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.01 109.41 21.4 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.483 176.433 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.638 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 8.8 t -123.85 136.76 54.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.189 0.519 . . . . 0.0 110.72 -178.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -83.71 5.2 25.52 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.257 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.44 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -112.32 152.89 28.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.77 0.319 . . . . 0.0 110.639 179.05 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.44 ' H ' HD13 ' A' ' 39' ' ' LEU . 17.4 t0 . . . . . 0 C--N 1.325 -0.489 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.343 -174.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.497 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 49.3 mt . . . . . 0 N--CA 1.446 -0.643 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.588 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 49.9 Cg_exo -56.29 163.53 6.32 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 121.759 1.639 . . . . 0.0 110.925 174.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -55.6 -38.3 69.25 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.949 -170.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -76.29 -25.32 66.28 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.147 -0.549 . . . . 0.0 114.323 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.588 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 88.5 m95 -83.99 143.55 29.72 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -172.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.425 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -121.15 149.54 42.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.634 173.595 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -98.82 103.09 15.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.107 0.479 . . . . 0.0 109.769 179.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -105.31 167.22 9.88 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.143 -177.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.9 m -134.57 138.8 44.89 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.077 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.483 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -78.18 172.29 13.78 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 121.349 0.595 . . . . 0.0 109.47 178.185 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -72.47 -10.37 59.7 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.771 -172.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.483 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 35.5 m-80 -100.05 -1.59 36.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.265 0.555 . . . . 0.0 110.004 178.079 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 90.55 15.45 56.85 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.564 -0.744 . . . . 0.0 113.252 176.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -88.2 120.9 30.0 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 173.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -74.68 154.01 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.389 0.614 . . . . 0.0 110.829 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -160.75 155.26 23.51 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.293 176.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -113.12 136.98 52.12 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.951 -175.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.734 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.74 122.35 49.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.242 0.544 . . . . 0.0 111.087 -177.816 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.495 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -76.0 128.16 34.47 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 172.942 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.425 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 67.4 m-70 -99.05 15.07 27.03 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.806 0.336 . . . . 0.0 111.317 -175.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 21.9 mm -91.49 -55.52 6.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.085 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -120.64 3.01 10.69 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.5 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.0 OUTLIER 73.61 79.42 0.13 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.454 -0.793 . . . . 0.0 112.611 170.199 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.669 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -122.77 118.27 27.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.293 173.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.734 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.78 114.71 29.02 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.172 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.435 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 2.2 t -126.25 134.13 51.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.658 0.266 . . . . 0.0 110.772 -179.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -79.26 -17.83 53.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.142 0.496 . . . . 0.0 110.971 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.4 159.34 16.22 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.589 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.3 t70 . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.753 -176.742 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.553 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 84.2 mt . . . . . 0 N--CA 1.449 -0.508 0 N-CA-C 110.394 -0.225 . . . . 0.0 110.394 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.579 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 36.5 Cg_exo -63.63 177.4 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.393 2.062 . . . . 0.0 112.465 173.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -58.39 -39.05 78.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.766 -171.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -90.99 -15.64 55.81 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.56 -0.829 . . . . 0.0 113.909 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.581 ' HZ3' HG22 ' A' ' 37' ' ' THR . 85.3 m95 -89.22 139.47 30.45 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -171.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -120.36 132.13 55.14 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.853 174.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -80.84 104.48 11.38 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 176.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.564 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.0 OUTLIER -114.93 164.5 14.05 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.371 -178.422 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 18.2 m -129.27 138.81 51.85 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.4 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.18 178.71 3.7 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.504 0.668 . . . . 0.0 110.946 -177.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.427 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -68.15 -19.94 64.85 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.864 -173.307 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -93.06 -43.81 8.7 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.443 -178.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 139.05 18.5 0.51 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.665 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.509 ' HB3' ' HE2' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -90.63 126.96 36.13 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 175.462 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -79.79 153.83 4.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 120.283 -0.567 . . . . 0.0 110.743 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.7 p90 -162.97 158.72 22.63 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.843 178.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -116.94 138.08 51.79 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.514 -177.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.619 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.8 124.35 53.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.364 0.602 . . . . 0.0 111.411 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -74.31 107.76 6.67 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 170.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -82.52 1.19 39.03 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.159 0.504 . . . . 0.0 111.117 -174.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.3 mm -97.73 -55.38 6.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.351 0.596 . . . . 0.0 109.623 176.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -92.56 -1.12 57.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.379 -176.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm 59.6 61.51 1.96 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.692 175.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.588 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -124.07 117.78 25.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.611 175.647 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.619 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -103.72 114.11 28.12 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.289 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.581 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 3.3 t -125.54 132.42 52.59 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.976 0.417 . . . . 0.0 110.746 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.509 ' HE2' ' HB3' ' A' ' 25' ' ' GLN . 26.0 m-85 -83.75 -4.91 59.01 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.764 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.583 HD12 ' H ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -115.54 172.08 7.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.436 175.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.583 ' H ' HD12 ' A' ' 39' ' ' LEU . 10.1 t70 . . . . . 0 C--N 1.325 -0.5 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.282 -174.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.666 HD11 ' HD1' ' A' ' 28' ' ' PHE . 43.9 mt . . . . . 0 N--CA 1.456 -0.175 0 CA-C-O 120.725 0.298 . . . . 0.0 111.436 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.519 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 50.7 Cg_exo -59.39 173.9 1.27 Allowed 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 123.366 2.711 . . . . 0.0 112.348 170.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.4 -41.72 94.46 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.034 -175.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -74.48 -28.89 62.68 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.613 -177.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.544 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 91.6 m95 -83.84 134.53 34.7 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.252 0.549 . . . . 0.0 112.394 -173.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -119.35 143.09 47.59 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.563 174.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -94.34 106.76 18.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.922 0.391 . . . . 0.0 109.997 -177.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.572 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.5 mt-10 -114.85 167.8 10.46 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.373 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.2 m -124.29 136.63 54.27 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.173 175.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.1 177.32 9.03 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.099 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -64.92 -35.01 79.77 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.245 -176.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -67.05 -37.72 84.54 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.301 0.572 . . . . 0.0 109.82 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 116.6 15.96 6.68 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.343 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -87.69 137.69 32.12 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 173.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.9 p -84.26 145.5 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 120.015 -0.674 . . . . 0.0 109.938 178.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.533 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.2 p90 -147.18 155.49 42.16 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.502 -179.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.666 ' HD1' HD11 ' A' ' 12' ' ' LEU . 17.9 m-85 -114.35 132.17 56.29 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.872 -174.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.572 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -131.07 120.3 46.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-O 121.142 0.496 . . . . 0.0 110.85 -179.122 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.502 ' HB3' ' HD3' ' A' ' 35' ' ' ARG . 4.6 t0 -78.7 112.68 16.06 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 171.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.6 m-70 -82.82 -10.15 58.99 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.043 -172.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.0 mm -75.32 -56.54 8.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.943 ' HB2' ' HD2' ' A' ' 35' ' ' ARG . 61.9 m-80 -93.57 -5.08 49.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.599 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.5 mmtm 62.82 61.69 1.13 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.832 176.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.943 ' HD2' ' HB2' ' A' ' 33' ' ' ASN . 0.8 OUTLIER -122.74 123.34 40.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.56 176.3 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.56 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -105.23 117.41 33.93 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.692 179.809 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.537 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 1.8 t -125.49 130.97 52.84 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.892 0.377 . . . . 0.0 110.247 177.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.519 ' HA ' ' CB ' ' A' ' 27' ' ' PHE . 11.2 m-85 -78.53 -17.25 56.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.023 -177.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -112.88 166.47 11.36 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 120.87 0.366 . . . . 0.0 111.009 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.7 t0 . . . . . 0 C--N 1.324 -0.501 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.695 -177.281 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.496 HD11 ' CD1' ' A' ' 28' ' ' PHE . 17.1 mt . . . . . 0 N--CA 1.452 -0.366 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.501 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 76.8 Cg_exo -55.21 177.86 0.1 Allowed 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.6 2.867 . . . . 0.0 112.885 172.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -65.07 -43.12 93.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.54 -176.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.37 -28.94 72.02 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.249 -0.501 . . . . 0.0 112.613 -176.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.515 ' HZ3' HG22 ' A' ' 37' ' ' THR . 92.8 m95 -83.74 146.91 27.93 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -129.32 138.54 51.64 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.321 175.09 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -93.13 101.18 13.47 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.595 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 2.0 mt-10 -106.1 164.06 12.29 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.053 -178.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 12.7 m -125.65 134.28 51.92 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.018 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.419 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -73.67 172.94 10.5 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 121.269 0.556 . . . . 0.0 110.053 179.021 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.442 ' HG3' ' H ' ' A' ' 22' ' ' GLU . 0.3 OUTLIER -65.93 -27.14 67.95 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.484 -173.945 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.419 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 40.3 m-80 -76.98 -36.89 56.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.311 0.577 . . . . 0.0 109.68 177.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 126.79 7.6 5.07 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.891 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -78.02 116.43 18.5 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 176.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.2 p -74.14 154.76 6.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-O 121.176 0.513 . . . . 0.0 110.209 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.537 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 51.9 p90 -164.74 159.76 19.02 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.542 -0.753 . . . . 0.0 110.416 -177.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.496 ' CD1' HD11 ' A' ' 12' ' ' LEU . 6.9 m-85 -114.39 130.66 56.71 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.71 -176.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.595 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -130.93 127.57 61.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 121.174 0.512 . . . . 0.0 110.08 176.816 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.667 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -75.38 136.17 40.78 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 173.762 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.4 m-70 -107.63 28.67 7.94 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.26 0.553 . . . . 0.0 111.429 -176.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.3 mm -107.95 -54.91 5.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 171.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.49 ' O ' ' HB2' ' A' ' 34' ' ' LYS . 59.3 m-80 -95.13 -28.51 15.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.835 177.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.667 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.1 OUTLIER 79.49 53.21 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.237 174.12 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.38 131.76 54.77 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.448 174.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.55 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -96.5 125.81 41.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.852 -178.271 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.515 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 2.7 t -125.77 138.17 53.84 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.928 0.394 . . . . 0.0 110.104 175.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -89.16 -8.18 54.19 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.531 178.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.452 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -112.51 157.51 21.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.39 179.186 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.452 ' H ' HD13 ' A' ' 39' ' ' LEU . 12.2 t70 . . . . . 0 C--N 1.325 -0.496 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.6 -177.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.533 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 24.3 mt . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.926 0.393 . . . . 0.0 111.474 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.535 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 32.6 Cg_exo -61.27 169.87 5.85 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.167 2.578 . . . . 0.0 112.515 174.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.59 -40.03 62.23 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.335 -0.848 . . . . 0.0 113.169 -173.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -83.33 -12.3 78.93 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.39 -0.909 . . . . 0.0 113.68 -175.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.615 ' HZ3' HG22 ' A' ' 37' ' ' THR . 87.6 m95 -92.27 137.97 31.92 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -172.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -120.45 141.69 49.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.542 174.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.764 HE21 ' HE1' ' A' ' 28' ' ' PHE . 20.4 tt0 -92.84 104.2 16.48 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.552 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.7 mt-10 -114.67 168.63 9.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.648 -176.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.24 140.57 51.86 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.205 176.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.468 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -77.53 -176.56 4.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.191 0.52 . . . . 0.0 110.349 179.846 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.7 -26.37 66.14 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.427 -176.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.468 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 16.6 m-80 -84.44 -43.16 14.91 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.083 0.468 . . . . 0.0 110.842 -178.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 131.2 16.5 1.54 Allowed Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.906 -0.664 . . . . 0.0 111.854 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.0 126.96 35.64 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 174.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -80.05 152.1 4.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.352 0.596 . . . . 0.0 110.849 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.552 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 54.1 p90 -157.63 166.03 33.94 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.704 -178.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.764 ' HE1' HE21 ' A' ' 18' ' ' GLN . 7.7 m-85 -118.34 134.96 54.61 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.703 -179.061 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.549 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -129.45 124.94 60.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-O 121.138 0.494 . . . . 0.0 111.0 -179.828 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.611 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 2.6 t0 -73.56 114.06 11.38 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 171.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -86.99 0.27 55.45 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.749 -0.38 . . . . 0.0 112.012 -172.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -79.42 -49.51 19.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -101.16 -11.39 19.59 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.279 -178.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.67 58.98 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.181 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.611 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -122.29 125.68 46.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.689 179.27 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -96.93 129.35 44.39 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.001 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.615 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 7.1 t -125.51 132.22 52.67 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 172.263 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -93.02 0.05 57.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.453 0.644 . . . . 0.0 109.998 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -116.65 159.53 22.06 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.26 173.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.1 t70 . . . . . 0 C--N 1.319 -0.731 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.653 -174.814 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.403 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 7.9 mt . . . . . 0 N--CA 1.45 -0.469 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.55 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.9 Cg_exo -56.17 173.26 0.46 Allowed 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.844 2.362 . . . . 0.0 112.251 172.115 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -61.46 -39.38 90.66 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.837 -173.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -75.92 -24.7 68.7 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.919 -0.657 . . . . 0.0 114.062 -175.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.55 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 88.2 m95 -82.42 138.2 34.49 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -171.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.445 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -118.19 153.56 33.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.834 175.369 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.425 HE21 HG21 ' A' ' 26' ' ' VAL . 45.6 tt0 -107.79 106.63 17.01 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.468 178.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.513 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.1 mt-10 -110.78 178.55 4.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.436 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.19 138.13 53.62 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.477 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.525 ' OD1' ' HG3' ' A' ' 22' ' ' GLU . 0.8 OUTLIER -107.86 179.24 4.28 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 -179.056 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.525 ' HG3' ' OD1' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -26.4 -78.6 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -166.767 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -88.35 35.44 0.76 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.166 0.507 . . . . 0.0 111.915 -170.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.51 4.84 89.97 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.888 -0.672 . . . . 0.0 111.486 178.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -61.14 113.93 2.85 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.36 -0.42 . . . . 0.0 109.917 177.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.425 HG21 HE21 ' A' ' 18' ' ' GLN . 1.3 p -78.7 153.25 4.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.201 0.524 . . . . 0.0 110.752 -179.169 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.513 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 53.9 p90 -157.94 161.18 38.19 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.906 177.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.403 ' HA ' ' O ' ' A' ' 17' ' ' GLU . 15.2 m-85 -116.97 137.13 52.42 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.089 -175.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.511 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.2 OUTLIER -129.54 121.03 52.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.342 0.591 . . . . 0.0 111.344 -178.652 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.717 ' HB3' ' HG2' ' A' ' 35' ' ' ARG . 43.0 t0 -78.31 117.22 19.34 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.722 -1.127 . . . . 0.0 108.958 177.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.445 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 73.7 m-70 -89.39 -4.07 58.19 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.815 0.34 . . . . 0.0 111.17 -176.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 17.7 mm -95.79 -42.79 12.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.195 0.521 . . . . 0.0 110.048 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.525 ' CB ' ' HD3' ' A' ' 35' ' ' ARG . 69.5 m-80 -98.13 -7.43 29.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.002 -179.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.01 51.59 2.8 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.404 173.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.717 ' HG2' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -125.9 142.3 51.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.679 0.276 . . . . 0.0 111.472 177.026 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.511 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -111.15 119.17 38.07 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.262 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.548 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 15.3 t -125.25 137.7 54.1 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.056 0.455 . . . . 0.0 110.891 178.576 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -91.65 3.81 54.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.898 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.92 163.92 16.84 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.832 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.7 t70 . . . . . 0 C--N 1.323 -0.568 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.567 -177.806 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.789 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--O 1.235 0.304 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.451 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 47.4 Cg_exo -60.6 -168.73 0.05 OUTLIER 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.826 3.017 . . . . 0.0 112.475 169.376 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.45 -45.32 72.83 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.011 -174.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -82.02 -21.96 60.19 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.64 -0.791 . . . . 0.0 113.157 -175.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.789 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 85.6 m95 -83.28 144.89 29.42 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -171.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.416 ' HB2' ' HD2' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -124.73 146.83 48.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.115 174.185 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.503 ' HB2' ' CD2' ' A' ' 12' ' ' LEU . 28.0 tt0 -100.6 100.96 11.75 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.618 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 5.0 mt-10 -108.91 168.17 9.55 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.102 0.477 . . . . 0.0 110.99 -175.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -114.28 137.62 51.56 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.549 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -176.14 4.92 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.097 0.475 . . . . 0.0 110.677 -179.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -70.45 -30.0 66.72 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.248 -175.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -78.34 -43.77 26.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.185 0.517 . . . . 0.0 109.764 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 128.74 25.78 0.99 Allowed Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.998 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.7 149.36 23.4 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 174.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.406 HG21 HE21 ' A' ' 18' ' ' GLN . 1.4 p -90.49 156.07 3.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.35 0.595 . . . . 0.0 110.653 -179.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 46.0 p90 -161.05 163.72 31.37 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.592 178.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.689 ' CD1' HD21 ' A' ' 12' ' ' LEU . 14.3 m-85 -117.2 131.42 56.87 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.484 -176.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.642 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.46 122.04 46.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.329 0.585 . . . . 0.0 110.791 179.519 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.549 ' HA ' ' HA ' ' A' ' 16' ' ' TRP . 0.0 OUTLIER -77.83 126.62 31.12 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 172.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.416 ' HD2' ' HB2' ' A' ' 17' ' ' GLU . 64.5 m-70 -99.56 9.5 43.08 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.39 -174.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.5 mm -94.2 -49.34 12.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.093 0.473 . . . . 0.0 109.891 175.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -108.96 -1.52 18.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.648 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm 64.72 65.41 0.62 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 170.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.588 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -123.72 134.12 53.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.565 0.222 . . . . 0.0 111.094 173.856 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.642 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -112.1 118.75 36.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.664 179.413 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.499 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 1.8 t -125.98 136.84 53.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.775 0.321 . . . . 0.0 110.517 176.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -87.28 -7.23 58.08 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.062 0.458 . . . . 0.0 110.659 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.43 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -113.8 164.42 13.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.759 176.249 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.414 ' H ' HD13 ' A' ' 39' ' ' LEU . 9.7 t70 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.858 -176.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.474 HD11 ' HB2' ' A' ' 18' ' ' GLN . 14.5 mt . . . . . 0 N--CA 1.427 -1.596 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.535 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 26.9 Cg_exo -63.15 168.26 11.16 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.479 2.119 . . . . 0.0 112.065 178.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.53 -39.45 80.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.688 -174.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -80.22 -20.79 66.39 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.553 -0.832 . . . . 0.0 113.047 -176.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.535 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 79.8 m95 -86.24 138.95 31.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.402 0.62 . . . . 0.0 112.36 -176.362 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -122.8 143.59 49.74 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.011 175.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.474 ' HB2' HD11 ' A' ' 12' ' ' LEU . 8.4 tt0 -93.42 110.55 22.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.074 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.657 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 2.3 mt-10 -119.92 165.28 14.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.515 -178.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.3 m -121.61 133.89 55.0 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.573 177.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.77 -177.8 6.81 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.255 0.55 . . . . 0.0 111.075 -176.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.97 -18.06 62.02 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.931 -174.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -88.5 -8.36 54.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.339 0.59 . . . . 0.0 109.563 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.1 19.05 58.24 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.06 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -97.44 135.63 39.03 Favored 'General case' 0 N--CA 1.438 -1.038 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 176.194 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.0 p -78.47 151.01 5.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.717 0.77 . . . . 0.0 111.084 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.657 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 50.8 p90 -150.84 160.85 43.61 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.135 177.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -116.55 137.93 51.8 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.571 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.53 126.52 55.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 CA-C-O 121.294 0.568 . . . . 0.0 111.492 -179.079 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.561 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 4.8 t70 -77.33 123.61 26.73 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.914 -1.039 . . . . 0.0 108.46 172.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 73.1 m-70 -98.73 9.11 44.06 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.322 -175.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 13.6 mm -91.27 -57.03 4.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.911 178.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.61 1.5 19.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.177 178.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 12.2 mptt 67.03 72.47 0.36 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.317 -0.856 . . . . 0.0 113.084 168.381 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.2 OUTLIER -123.84 120.31 32.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.573 172.172 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.571 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -97.57 117.1 31.07 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.235 176.309 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.524 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 2.7 t -125.63 131.9 52.58 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.856 0.36 . . . . 0.0 110.761 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -79.87 -15.7 56.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.373 0.606 . . . . 0.0 109.699 178.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.47 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER -102.52 161.5 13.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.834 -178.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.47 ' H ' HD13 ' A' ' 39' ' ' LEU . 55.5 t0 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.349 -175.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.407 HD11 ' CD1' ' A' ' 28' ' ' PHE . 0.8 OUTLIER . . . . . 0 N--CA 1.452 -0.337 0 CA-C-O 120.674 0.273 . . . . 0.0 111.615 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.502 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 72.9 Cg_exo -54.75 173.65 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 123.17 2.58 . . . . 0.0 112.551 170.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -65.15 -39.84 93.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.196 -174.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.15 -28.82 73.21 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.398 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.544 ' HZ3' HG22 ' A' ' 37' ' ' THR . 89.6 m95 -83.66 122.0 28.03 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.935 0.716 . . . . 0.0 112.935 -174.271 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -101.87 130.51 48.36 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.009 174.131 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.467 HE21 HG21 ' A' ' 26' ' ' VAL . 54.4 tt0 -85.01 100.19 11.5 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.039 0.447 . . . . 0.0 110.191 177.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.606 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 2.0 mm-40 -106.91 173.62 6.24 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.732 -176.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 8.0 m -126.39 139.45 53.26 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.241 175.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.473 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -83.74 177.51 8.33 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.17 0.51 . . . . 0.0 110.296 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.503 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -70.71 -23.69 62.51 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.368 -174.978 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.473 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 41.1 m-80 -83.96 -11.28 57.08 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.241 0.543 . . . . 0.0 110.39 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 95.48 12.51 53.82 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.473 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -81.57 139.56 35.0 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 174.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.467 HG21 HE21 ' A' ' 18' ' ' GLN . 0.8 OUTLIER -86.45 149.37 4.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.854 176.819 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.431 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 44.1 p90 -157.54 158.13 35.08 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.095 -0.957 . . . . 0.0 109.984 -179.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.407 ' CD1' HD11 ' A' ' 12' ' ' LEU . 10.5 m-85 -114.97 131.98 56.73 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.205 -175.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.612 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -129.35 120.53 51.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-O 121.614 0.721 . . . . 0.0 111.113 178.532 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.41 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 38.2 t0 -73.01 120.72 19.03 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.545 173.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -93.75 1.38 56.53 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.897 0.38 . . . . 0.0 110.463 -178.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.2 mm -101.81 -51.92 8.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.382 0.611 . . . . 0.0 109.632 175.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -89.11 -11.18 44.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.725 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.411 ' HD2' ' HA ' ' A' ' 34' ' ' LYS . 2.6 mmmm 62.64 57.08 1.87 Allowed 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.266 0.626 . . . . 0.0 112.564 175.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.57 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -124.57 125.68 44.57 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.303 175.638 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.612 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -102.08 115.64 30.98 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 174.562 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.544 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 1.6 t -126.09 134.44 51.37 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.803 0.335 . . . . 0.0 110.581 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -84.2 -4.38 58.78 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.04 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -121.61 166.7 13.83 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.96 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.7 t0 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.901 -179.951 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 19.9 mt . . . . . 0 N--CA 1.454 -0.261 0 CA-C-O 120.319 0.104 . . . . 0.0 111.025 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.553 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 51.0 Cg_exo -57.28 168.33 2.86 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 122.911 2.408 . . . . 0.0 112.312 174.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.86 -39.23 68.41 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.736 -0.665 . . . . 0.0 112.212 -174.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -77.98 -22.73 68.08 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.4 -176.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.553 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 92.0 m95 -88.41 131.0 35.03 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -173.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.415 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 15.7 mm-40 -112.61 140.06 47.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.34 174.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.704 HE21 ' HE1' ' A' ' 28' ' ' PHE . 32.3 tt0 -93.27 104.16 16.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.028 0.442 . . . . 0.0 110.164 179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.618 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 4.1 mt-10 -109.81 168.45 9.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.713 -177.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.8 m -125.63 134.02 52.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.127 175.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.412 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -79.13 -176.51 5.16 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.188 0.518 . . . . 0.0 110.865 -177.56 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.467 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 1.0 OUTLIER -67.42 -32.41 73.27 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.472 -177.42 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.412 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 31.3 m-80 -77.75 -23.58 49.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.265 0.555 . . . . 0.0 110.276 -178.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 104.26 14.88 23.09 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.512 -178.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -84.76 137.95 32.9 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 174.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.1 p -84.88 153.96 3.58 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-O 121.476 0.655 . . . . 0.0 110.229 177.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 50.0 p90 -160.19 161.65 33.64 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.47 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.704 ' HE1' HE21 ' A' ' 18' ' ' GLN . 12.5 m-85 -119.38 135.99 54.48 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.388 -176.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.527 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.1 121.97 50.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.691 179.871 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.825 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 7.0 t0 -75.1 118.61 18.24 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 171.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.415 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 28.0 m-70 -87.52 -4.22 58.98 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -171.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.4 mt -86.96 -42.79 15.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.947 0.403 . . . . 0.0 110.378 176.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.4 m-80 -101.95 -5.74 24.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.077 179.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.44 58.94 3.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.06 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.825 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 1.3 ptt180 -121.57 121.01 36.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.745 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.527 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -101.78 120.71 40.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.928 -178.813 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.463 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 1.6 t -126.11 137.83 53.63 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.693 0.282 . . . . 0.0 110.486 175.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -89.15 -3.83 58.48 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.21 0.528 . . . . 0.0 109.976 177.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.411 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -106.17 156.85 18.03 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.989 175.887 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.411 ' H ' HD13 ' A' ' 39' ' ' LEU . 5.5 t0 . . . . . 0 C--N 1.322 -0.614 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.213 -175.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.508 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 35.3 mt . . . . . 0 N--CA 1.455 -0.204 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.511 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 31.3 Cg_exo -61.09 -172.47 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 123.357 2.704 . . . . 0.0 113.336 176.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -54.56 45.68 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.416 -172.366 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -78.23 -17.26 78.39 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.615 -0.721 . . . . 0.0 113.315 -173.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.575 ' CZ3' HG22 ' A' ' 37' ' ' THR . 92.6 m95 -85.35 133.65 34.13 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.514 0.673 . . . . 0.0 112.735 -170.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -120.42 135.9 54.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.578 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -85.12 109.44 18.26 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.616 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.1 mm-40 -118.35 166.99 11.98 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.421 -176.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.8 m -127.69 135.38 50.11 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.87 173.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.73 -178.23 5.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.369 0.604 . . . . 0.0 110.917 -177.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -32.08 73.38 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.309 -175.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -74.29 -41.66 60.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.436 0.636 . . . . 0.0 110.303 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 125.91 14.05 3.18 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.713 -179.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.39 127.5 34.39 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 175.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -79.17 151.69 4.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.348 0.594 . . . . 0.0 110.228 178.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.405 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.5 p90 -162.09 160.61 27.57 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.518 -178.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.413 ' CD1' HD11 ' A' ' 12' ' ' LEU . 3.2 m-85 -115.25 135.62 53.96 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.828 -179.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.616 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -125.68 129.29 72.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.424 0.63 . . . . 0.0 110.981 177.729 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.522 ' HB3' ' CG ' ' A' ' 35' ' ' ARG . 5.2 t0 -77.76 109.76 12.03 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.638 -1.165 . . . . 0.0 108.404 174.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -85.35 9.24 16.01 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.457 -174.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -94.76 -52.63 9.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.902 0.382 . . . . 0.0 110.082 174.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -103.55 -1.43 28.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.233 -178.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.8 mmtp 63.87 61.17 0.98 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.125 0.57 . . . . 0.0 111.981 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.522 ' CG ' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -123.97 135.93 53.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.896 176.886 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -107.13 123.68 48.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.006 -179.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.575 HG22 ' CZ3' ' A' ' 16' ' ' TRP . 6.8 t -126.53 135.77 51.72 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.943 0.401 . . . . 0.0 110.512 173.122 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -88.55 -1.52 58.1 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.99 0.424 . . . . 0.0 110.512 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.687 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -122.42 165.64 16.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.142 178.326 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.687 ' H ' HD13 ' A' ' 39' ' ' LEU . 8.3 t70 . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.741 -179.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.5 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 16.0 mt . . . . . 0 N--CA 1.448 -0.554 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.54 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 39.6 Cg_exo -59.62 163.37 13.26 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.332 2.021 . . . . 0.0 111.499 169.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -56.42 -38.64 71.84 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -173.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.7 -23.67 76.65 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 121.123 -0.561 . . . . 0.0 113.421 -178.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.571 ' HZ3' HG22 ' A' ' 37' ' ' THR . 87.3 m95 -85.66 129.33 34.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.328 0.585 . . . . 0.0 112.366 -174.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -110.23 139.8 45.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.329 171.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -95.22 107.83 19.94 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.584 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.5 mm-40 -113.47 167.79 10.29 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.932 -174.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.4 m -116.23 140.07 49.69 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 177.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -179.04 7.24 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.026 0.441 . . . . 0.0 110.727 -179.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.459 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -61.74 -32.83 73.1 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.718 -177.36 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -82.53 -43.8 16.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.781 -177.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 136.38 5.81 1.98 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 121.165 -0.541 . . . . 0.0 111.753 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.49 137.8 38.12 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 176.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.5 p -88.92 152.2 3.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.419 0.628 . . . . 0.0 110.642 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.519 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 45.5 p90 -154.53 161.92 41.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.79 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -115.64 133.06 56.4 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.862 -176.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.604 ' HA ' ' O ' ' A' ' 35' ' ' ARG . 0.1 OUTLIER -131.42 119.92 44.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.316 0.579 . . . . 0.0 111.234 179.792 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.615 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 5.6 t0 -78.03 110.37 12.91 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 171.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -81.67 -8.12 59.67 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.035 -173.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.6 mm -77.96 -55.96 8.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.249 178.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -99.03 -0.03 42.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.357 -177.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? 68.6 60.46 0.37 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.861 173.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.615 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -122.71 119.79 31.73 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.286 177.902 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.559 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -107.75 112.79 25.64 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.055 177.389 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.571 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 3.4 t -126.24 130.89 51.81 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.064 0.459 . . . . 0.0 110.908 179.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -82.34 -10.4 59.1 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.591 179.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.17 162.42 14.96 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.061 178.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.4 t0 . . . . . 0 C--N 1.324 -0.538 0 O-C-N 123.635 0.584 . . . . 0.0 110.94 -176.922 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.451 -0.413 0 N-CA-C 110.415 -0.217 . . . . 0.0 110.415 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.575 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 51.3 Cg_exo -56.8 165.67 4.6 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.247 1.965 . . . . 0.0 111.278 170.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -61.58 -38.28 86.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.658 -171.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.63 -25.19 75.79 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.161 -0.542 . . . . 0.0 113.548 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.575 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 86.3 m95 -83.78 144.14 29.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.515 0.674 . . . . 0.0 112.676 -174.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.54 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 2.0 mt-10 -127.29 149.31 50.08 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.095 174.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.633 HE21 ' HE1' ' A' ' 28' ' ' PHE . 35.5 tt0 -96.88 102.89 14.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.697 177.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.507 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.6 mt-10 -105.48 178.86 4.44 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.989 0.423 . . . . 0.0 110.424 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.8 m -131.5 139.58 49.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.325 176.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.401 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -78.52 176.64 9.22 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.338 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.477 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 2.4 pt-20 -67.29 -26.34 66.49 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.771 -174.163 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.401 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 35.6 m-80 -84.9 -35.11 22.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.963 0.411 . . . . 0.0 110.219 -179.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 126.15 15.09 2.87 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.216 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -83.52 142.52 30.84 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 174.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -90.97 154.94 3.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.303 0.573 . . . . 0.0 110.507 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.438 ' CB ' ' HA ' ' A' ' 38' ' ' TYR . 50.6 p90 -161.96 161.08 28.47 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.264 178.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.633 ' HE1' HE21 ' A' ' 18' ' ' GLN . 14.0 m-85 -116.88 139.96 50.01 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.045 -176.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.547 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.77 123.68 52.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.218 0.532 . . . . 0.0 111.515 -177.916 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -73.03 114.62 11.39 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 170.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.54 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 50.3 m-70 -84.98 -4.13 59.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.789 0.328 . . . . 0.0 111.375 -175.406 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.5 mm -95.97 -49.78 12.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.4 0.619 . . . . 0.0 109.952 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -98.43 -5.89 31.6 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.04 -177.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.16 56.32 1.77 Allowed 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 175.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.516 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -119.13 120.68 37.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.738 177.896 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.547 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -105.0 116.2 31.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.312 179.331 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.413 HG22 ' CZ3' ' A' ' 16' ' ' TRP . 1.2 t -126.05 132.29 51.99 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.673 0.273 . . . . 0.0 110.429 177.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.438 ' HA ' ' CB ' ' A' ' 27' ' ' PHE . 8.2 m-85 -72.87 -25.52 61.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.019 0.438 . . . . 0.0 111.104 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.33 170.4 7.95 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.629 178.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 t0 . . . . . 0 C--N 1.323 -0.581 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.594 -175.272 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.617 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 15.9 mt . . . . . 0 N--CA 1.447 -0.606 0 CA-C-O 120.915 0.388 . . . . 0.0 111.463 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.451 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 46.4 Cg_exo -59.25 175.82 0.65 Allowed 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.382 2.722 . . . . 0.0 111.704 170.248 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -64.53 -40.1 94.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.258 -173.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.1 -29.28 73.32 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.828 -0.701 . . . . 0.0 113.021 -178.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.617 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 92.0 m95 -82.44 132.5 35.21 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -173.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.407 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -115.31 142.24 46.95 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.852 174.758 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.831 HE21 ' HE1' ' A' ' 28' ' ' PHE . 34.2 tt0 -91.22 102.77 15.49 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 176.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.665 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.6 mm-40 -110.57 168.82 9.18 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.296 0.57 . . . . 0.0 111.069 -175.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.1 m -122.99 135.15 54.36 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.661 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.52 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -83.07 -179.1 7.34 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.415 179.567 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.472 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 1.6 pt-20 -72.61 -15.98 61.73 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.515 -175.001 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.52 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 38.5 m-80 -88.31 -10.66 48.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.909 0.385 . . . . 0.0 110.314 177.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.17 17.22 57.94 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.787 -177.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -91.92 144.56 25.34 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -88.15 156.24 3.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.349 0.595 . . . . 0.0 110.81 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.453 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.5 p90 -162.21 160.61 27.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.096 177.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.831 ' HE1' HE21 ' A' ' 18' ' ' GLN . 13.8 m-85 -116.82 135.28 53.86 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.219 -176.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.824 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.4 124.09 54.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 120.904 0.383 . . . . 0.0 110.825 179.704 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.546 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 1.4 t0 -76.78 131.64 38.82 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 170.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.407 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 70.8 m-70 -97.9 -0.75 44.37 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 121.003 -0.279 . . . . 0.0 111.651 -172.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.8 mt -92.58 -55.29 6.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.896 177.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -95.53 -14.96 23.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.748 0.308 . . . . 0.0 110.18 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 2.0 mmtt 70.58 71.76 0.2 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.98 176.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.578 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.6 mtp180 -122.38 119.12 30.1 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.24 174.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.824 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -104.01 114.09 28.09 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.469 178.833 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.31 138.59 53.08 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.666 0.269 . . . . 0.0 111.134 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -78.42 -14.65 59.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.848 0.356 . . . . 0.0 110.857 175.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.503 HD22 ' HA ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -102.86 155.57 18.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.497 -178.386 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.2 t0 . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.199 -175.707 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.686 0 N-CA-C 111.991 -0.443 . . . . 0.0 111.991 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.39 -20.83 50.35 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.671 0.236 . . . . 0.0 110.86 -178.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.15 33.26 22.68 Favored 'General case' 0 C--O 1.233 0.192 0 O-C-N 123.669 0.606 . . . . 0.0 111.0 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.01 60.67 4.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.943 -176.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.532 ' HD2' ' HA ' ' A' ' 5' ' ' ARG . 4.5 tpt85 -142.46 -35.84 0.42 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.279 177.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.2 mtmm -140.05 127.82 21.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.268 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.29 53.02 2.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.014 0.435 . . . . 0.0 110.688 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.1 p -139.73 126.7 23.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.123 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -167.83 -36.4 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.842 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.57 45.11 2.19 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 111.358 -0.697 . . . . 0.0 111.358 -174.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -82.55 -68.58 0.69 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.002 0.43 . . . . 0.0 111.047 -176.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 34.6 mt -83.5 161.81 55.42 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.353 -177.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.473 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 23.6 Cg_exo -65.61 159.38 48.44 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.87 2.38 . . . . 0.0 111.396 173.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.5 137.23 36.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 121.125 0.488 . . . . 0.0 110.128 171.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.56 -43.06 1.76 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.484 -175.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.473 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 95.2 m95 -75.94 132.87 40.52 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.943 0.719 . . . . 0.0 112.943 -175.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -114.09 142.87 45.66 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.722 174.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -97.4 117.1 30.89 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.3 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -127.41 174.54 8.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.087 0.47 . . . . 0.0 110.478 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -132.29 140.33 48.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.082 176.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.488 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -87.84 -173.81 4.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.074 0.464 . . . . 0.0 111.068 -178.501 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.542 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -73.56 -20.89 60.51 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.593 -176.885 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.488 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 44.0 m-80 -85.95 -6.4 59.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.098 0.475 . . . . 0.0 110.395 179.142 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.25 12.82 78.19 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.757 -178.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.49 124.59 32.98 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.9 p -73.6 145.63 11.33 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 120.048 -0.661 . . . . 0.0 110.381 178.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -148.31 159.35 44.08 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.263 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.522 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 18.6 m-85 -120.51 137.77 54.19 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.091 -175.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.632 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.13 118.61 37.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-O 121.38 0.609 . . . . 0.0 110.701 -178.302 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.598 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -76.27 138.71 40.73 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.948 176.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -109.38 23.5 14.38 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.045 0.45 . . . . 0.0 111.176 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.8 mm -103.07 -53.8 7.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.483 175.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.9 -22.3 15.86 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.263 175.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.598 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 1.0 OUTLIER 77.11 62.64 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.907 172.925 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.485 ' HG3' ' OD2' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -122.49 123.58 41.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.929 0.395 . . . . 0.0 111.311 174.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.632 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -87.42 119.72 27.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.108 175.015 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.438 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 6.3 t -123.76 136.68 54.57 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.15 0.5 . . . . 0.0 110.422 178.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -89.77 11.9 18.7 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.823 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.503 HD22 ' HA ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -122.0 156.92 32.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.445 179.129 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.531 ' OD1' ' HB2' ' A' ' 42' ' ' ARG . 8.3 t70 -74.1 118.01 66.07 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.925 -177.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.522 ' HD3' ' CD2' ' A' ' 28' ' ' PHE . 53.8 Cg_endo -94.18 43.75 0.22 Allowed 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 123.186 2.591 . . . . 0.0 112.666 -178.232 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.531 ' HB2' ' OD1' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -118.01 -4.45 11.05 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.073 176.67 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.7 -79.78 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 O-C-N 123.577 0.548 . . . . 0.0 112.061 -175.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -104.96 9.54 34.52 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.38 0.61 . . . . 0.0 110.712 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -102.16 64.92 0.95 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.814 -176.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.9 m -80.04 132.21 35.94 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.503 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.7 t -78.1 118.69 25.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.213 -178.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -97.78 96.92 8.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.462 177.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.595 ' HB3' ' HD3' ' A' ' 51' ' ' PRO . 2.5 t0 58.37 -162.7 0.22 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.282 -175.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.534 ' N ' ' HD3' ' A' ' 51' ' ' PRO . 1.9 p30 -147.31 55.38 2.34 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-O 120.613 0.244 . . . . 0.0 110.644 174.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.595 ' HD3' ' HB3' ' A' ' 49' ' ' ASP . 83.2 Cg_endo -96.42 -178.31 0.4 Allowed 'Trans proline' 0 N--CA 1.448 -1.171 0 C-N-CA 122.602 2.201 . . . . 0.0 112.132 -178.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.5 m -82.11 64.63 6.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.373 0.606 . . . . 0.0 109.766 173.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -94.77 121.28 63.26 Favored Pre-proline 0 N--CA 1.449 -0.5 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.911 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 1.3 Cg_endo . . . . . 0 C--O 1.246 0.906 0 C-N-CA 123.38 2.72 . . . . 0.0 111.251 175.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.915 0 N-CA-C 111.789 -0.524 . . . . 0.0 111.789 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -108.86 147.54 31.98 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 177.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.18 -135.66 0.21 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.548 -0.297 . . . . 0.0 110.606 -179.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -163.85 169.25 18.49 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -71.36 -79.51 0.07 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 173.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.08 40.81 18.23 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.318 173.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.1 mtp180 -138.54 45.84 2.03 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.1 0.476 . . . . 0.0 109.884 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.1 t -103.64 -53.53 7.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.379 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -143.47 134.66 25.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.85 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -138.98 115.66 1.16 Allowed Glycine 0 N--CA 1.445 -0.715 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 176.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.81 -46.92 64.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.172 0.511 . . . . 0.0 110.869 -178.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.468 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 4.2 mt -79.3 171.95 11.15 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.89 178.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.56 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.5 Cg_exo -57.53 163.09 9.17 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.309 2.006 . . . . 0.0 111.546 170.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.81 -34.06 71.08 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.414 -172.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -75.91 -23.74 71.28 Favored Glycine 0 CA--C 1.518 0.222 0 C-N-CA 121.083 -0.579 . . . . 0.0 113.278 -178.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.56 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 85.4 m95 -86.14 147.36 26.18 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.464 0.649 . . . . 0.0 112.654 -175.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.421 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 4.2 mm-40 -125.13 138.65 54.16 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.561 173.084 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -91.29 95.3 9.95 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.629 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.4 mm-40 -104.9 166.68 10.22 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.025 -175.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.0 m -124.72 137.65 54.33 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.565 176.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.91 -178.31 6.79 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.392 0.615 . . . . 0.0 110.814 -179.014 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.508 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -69.23 -29.02 66.86 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.753 -176.7 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -75.02 -33.17 61.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.237 0.542 . . . . 0.0 109.738 178.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 113.6 21.25 5.83 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.934 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -96.5 131.95 42.57 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 174.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -78.63 151.13 5.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.504 0.668 . . . . 0.0 110.349 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.4 p90 -154.56 161.2 41.74 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.289 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.443 ' CD1' HD11 ' A' ' 12' ' ' LEU . 14.1 m-85 -116.58 131.69 56.88 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.281 -176.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.718 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -128.94 123.8 59.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.278 0.561 . . . . 0.0 110.917 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -72.91 119.71 17.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 171.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.421 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 38.3 m-70 -89.51 0.73 56.68 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.276 0.56 . . . . 0.0 111.295 -174.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 12.3 mt -105.34 -52.53 7.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.871 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.472 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 71.0 m-80 -89.09 6.29 40.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.937 -178.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 33' ' ' ASN . 0.0 OUTLIER 42.27 53.9 4.35 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.607 1.163 . . . . 0.0 113.61 177.695 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.546 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 8.7 mtp180 -116.01 124.07 49.57 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 122.182 -0.324 . . . . 0.0 110.322 176.092 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.718 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.96 112.82 26.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.405 177.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.436 HG22 ' CZ3' ' A' ' 16' ' ' TRP . 12.4 t -126.21 139.71 53.13 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 120.877 0.37 . . . . 0.0 110.827 -179.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -91.2 5.42 49.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.87 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.612 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -121.08 165.87 14.71 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.883 178.418 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.612 ' H ' HD13 ' A' ' 39' ' ' LEU . 32.8 t0 -74.26 111.79 14.24 Favored Pre-proline 0 C--N 1.327 -0.399 0 O-C-N 123.4 0.438 . . . . 0.0 110.491 -178.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.518 ' O ' ' HB2' ' A' ' 45' ' ' PHE . 72.6 Cg_endo -80.76 7.87 4.61 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.867 2.378 . . . . 0.0 112.607 -176.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.5 mtp180 -103.68 -3.83 24.56 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.67 0.272 . . . . 0.0 110.774 176.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 28.5 mt -74.12 -81.34 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.623 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -93.23 7.54 43.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.218 0.532 . . . . 0.0 111.584 -175.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.518 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 7.0 m-85 -117.62 55.05 0.87 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.043 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -65.43 0.68 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.616 -177.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -70.56 -67.12 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.473 179.19 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -167.99 156.25 8.89 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 177.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -80.21 84.1 5.95 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 176.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.631 ' N ' ' HD3' ' A' ' 51' ' ' PRO . 7.5 t-20 -143.0 49.99 1.33 Allowed Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.339 -178.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.631 ' HD3' ' N ' ' A' ' 50' ' ' ASN . 1.5 Cg_endo -84.82 -30.94 0.47 Allowed 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.298 1.999 . . . . 0.0 111.93 175.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -143.24 -91.61 0.12 Allowed 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.205 0.526 . . . . 0.0 110.777 -177.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.92 120.62 3.63 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.507 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo . . . . . 0 C--O 1.252 1.183 0 C-N-CA 122.806 2.337 . . . . 0.0 112.147 -178.09 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.981 0 N-CA-C 111.786 -0.526 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.62 83.65 1.14 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.245 0.545 . . . . 0.0 111.174 -179.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -127.97 169.79 13.6 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.323 178.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.98 148.08 36.22 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.596 ' HE ' ' HA ' ' A' ' 49' ' ' ASP . 2.0 ttp85 -71.44 146.22 48.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.985 0.421 . . . . 0.0 111.319 -177.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.76 170.75 16.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.167 177.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.469 ' HD3' ' HA ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -77.76 95.19 4.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.976 0.417 . . . . 0.0 110.157 178.226 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.28 165.56 3.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.859 178.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 12' ' ' LEU . . . -152.33 -164.48 1.97 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.388 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -68.5 -66.88 2.13 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 121.144 -0.551 . . . . 0.0 112.913 -177.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.55 -84.39 0.1 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -179.158 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.659 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 0.1 OUTLIER -103.2 154.9 37.33 Favored Pre-proline 0 CA--C 1.515 -0.381 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 170.391 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.583 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 32.4 Cg_exo -57.24 167.46 3.44 Favored 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.315 2.01 . . . . 0.0 111.187 169.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.441 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 0.3 OUTLIER -55.94 -37.48 69.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.057 -174.09 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -78.42 -23.73 64.69 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.647 -0.787 . . . . 0.0 113.113 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.659 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 92.6 m95 -87.9 144.58 26.49 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -173.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.44 ' HB2' ' HD2' ' A' ' 31' ' ' HIS . 1.8 mm-40 -130.26 146.48 51.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.664 176.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.469 HE21 HG21 ' A' ' 26' ' ' VAL . 66.2 tt0 -97.43 104.38 16.39 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.985 0.422 . . . . 0.0 110.432 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.638 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.2 mt-10 -114.18 165.23 12.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.017 -178.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.43 145.37 44.18 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.933 0.397 . . . . 0.0 110.567 177.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.403 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -81.04 -177.93 6.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.975 0.416 . . . . 0.0 110.353 179.158 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.405 ' HG3' ' H ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -65.68 -28.16 68.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.668 -175.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.403 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 3.9 m-80 -85.18 -46.12 11.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.159 0.504 . . . . 0.0 110.737 -178.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.69 12.15 0.8 Allowed Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.899 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.48 133.67 34.46 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 175.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.469 HG21 HE21 ' A' ' 18' ' ' GLN . 1.5 p -86.16 153.93 3.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.428 0.632 . . . . 0.0 110.983 -178.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.638 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 54.4 p90 -155.29 163.0 40.73 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.834 -1.075 . . . . 0.0 109.263 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.688 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 11.4 m-85 -118.92 137.87 53.17 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.826 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.531 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -130.75 125.06 57.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 121.162 0.505 . . . . 0.0 111.269 -178.047 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.422 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 54.2 t0 -76.68 99.26 5.0 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 173.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.44 ' HD2' ' HB2' ' A' ' 17' ' ' GLU . 30.8 m-70 -75.82 -7.43 54.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.698 0.285 . . . . 0.0 111.193 -172.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 46.6 mm -63.29 -48.94 85.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.124 0.488 . . . . 0.0 110.317 176.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.69 2.47 14.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.598 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.496 ' N ' ' HE3' ' A' ' 34' ' ' LYS . 0.0 OUTLIER 60.61 62.99 1.4 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.588 176.307 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.422 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -122.84 125.34 45.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.753 0.311 . . . . 0.0 110.376 173.486 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.451 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -97.7 120.56 38.3 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.944 -178.707 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.561 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 12.8 t -126.37 139.28 53.4 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.152 0.501 . . . . 0.0 110.441 176.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -85.63 -12.05 52.37 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.368 0.604 . . . . 0.0 110.027 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.474 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -83.53 149.67 26.46 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.348 179.442 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.507 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 0.8 OUTLIER -78.77 119.52 77.56 Favored Pre-proline 0 N--CA 1.437 -1.089 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.166 -176.011 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.688 ' HD3' ' CD2' ' A' ' 28' ' ' PHE . 1.5 Cg_endo -86.39 39.36 0.64 Allowed 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 123.231 2.621 . . . . 0.0 112.152 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.428 HH11 ' HB2' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -112.14 36.27 3.42 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.27 0.557 . . . . 0.0 109.835 -179.703 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mt -112.57 -81.65 0.59 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.18 -177.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.68 3.25 41.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.253 0.549 . . . . 0.0 111.441 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -90.25 78.21 6.57 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.924 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -138.65 -170.25 2.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.635 -178.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 6.8 t -84.54 63.53 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.466 0.65 . . . . 0.0 111.053 -178.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -110.59 126.8 54.83 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 170.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.596 ' HA ' ' HE ' ' A' ' 5' ' ' ARG . 3.4 t0 -59.2 -81.19 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -171.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.8 t30 40.76 67.38 2.91 Favored Pre-proline 0 N--CA 1.47 0.567 0 O-C-N 124.084 0.865 . . . . 0.0 111.531 -174.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -80.39 51.3 3.86 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.737 2.291 . . . . 0.0 112.761 -175.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.29 163.13 27.32 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.901 0.381 . . . . 0.0 110.665 178.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.4 mmtt -66.56 151.05 96.85 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.862 176.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo . . . . . 0 C--O 1.247 0.956 0 C-N-CA 122.961 2.441 . . . . 0.0 112.477 -178.696 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.721 0 N-CA-C 111.836 -0.506 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.24 82.2 3.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.039 0.447 . . . . 0.0 110.614 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -140.58 114.19 8.79 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.466 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.546 ' HB2' ' HE2' ' A' ' 6' ' ' LYS . 3.1 pttt -60.98 -38.35 85.67 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.875 -179.486 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 54.06 43.93 30.02 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.728 176.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.546 ' HE2' ' HB2' ' A' ' 4' ' ' LYS . 8.4 mmtt -80.89 77.43 7.77 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 6' ' ' LYS . 17.1 mmt180 74.19 -48.76 0.66 Allowed 'General case' 0 N--CA 1.469 0.522 0 O-C-N 124.023 0.827 . . . . 0.0 110.689 -176.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 21.7 t -75.52 120.76 25.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.742 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -141.54 -24.84 0.71 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.431 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.04 41.47 60.78 Favored Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 -178.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -108.61 -45.35 3.87 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.86 0.362 . . . . 0.0 111.684 -174.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.0 mt -95.95 161.02 28.75 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.372 -171.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.456 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.0 Cg_exo -58.82 174.67 0.77 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.455 2.77 . . . . 0.0 112.319 170.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -64.77 -41.09 96.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.403 -175.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.34 -25.25 75.64 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.882 -0.675 . . . . 0.0 113.256 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.456 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 92.1 m95 -87.57 142.94 27.46 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.412 0.625 . . . . 0.0 112.601 -175.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.37 154.06 34.19 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.063 174.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -105.23 101.88 11.4 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.632 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.3 mm-40 -113.17 165.52 12.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.678 -175.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.7 m -116.45 138.25 51.52 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.794 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.78 178.6 7.24 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 121.343 0.592 . . . . 0.0 110.506 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.512 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.5 OUTLIER -59.68 -39.58 84.98 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.125 -177.239 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -73.08 -49.59 27.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.778 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 139.42 10.88 0.79 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.974 -0.631 . . . . 0.0 112.033 -178.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -85.66 143.17 28.56 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.4 p -86.35 156.7 3.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.233 0.539 . . . . 0.0 111.052 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.506 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 45.9 p90 -158.85 161.91 36.91 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.608 178.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.439 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 12.9 m-85 -116.97 132.52 56.68 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.442 -176.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.632 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -130.02 130.0 65.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.836 179.017 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.49 132.4 36.32 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 172.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.0 m-70 -100.77 15.76 27.27 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.251 -0.58 . . . . 0.0 111.666 -173.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.2 mt -99.01 -54.27 7.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.078 173.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.443 ' O ' ' HB2' ' A' ' 34' ' ' LYS . 2.7 m-80 -95.15 -15.97 22.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.249 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 33' ' ' ASN . 0.4 OUTLIER 74.31 39.49 0.47 Allowed 'General case' 0 N--CA 1.464 0.271 0 O-C-N 124.191 0.932 . . . . 0.0 111.529 177.796 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.503 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 58.5 mtp180 -89.8 136.01 33.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.86 0.362 . . . . 0.0 110.538 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -115.89 118.06 31.93 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.377 -178.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.427 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 2.3 t -125.46 131.94 52.78 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.004 0.431 . . . . 0.0 110.263 176.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -88.91 0.08 56.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.46 0.647 . . . . 0.0 109.926 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.92 163.45 15.54 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.031 176.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.551 ' OD1' ' HG2' ' A' ' 42' ' ' ARG . 32.3 t0 -66.78 121.23 76.69 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.715 -178.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.634 ' O ' ' HB2' ' A' ' 45' ' ' PHE . 9.5 Cg_exo -70.61 -17.97 33.35 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.343 2.695 . . . . 0.0 113.582 -175.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.551 ' HG2' ' OD1' ' A' ' 40' ' ' ASP . 6.1 ptp85 -88.75 5.95 41.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.993 0.425 . . . . 0.0 110.885 -177.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.548 ' CD1' ' HB3' ' A' ' 40' ' ' ASP . 86.3 mt -88.54 -93.84 0.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.457 178.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.66 3.6 40.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.907 -172.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.634 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 44.9 m-85 -105.86 5.96 31.14 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.103 0.478 . . . . 0.0 110.065 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.77 99.54 3.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.149 179.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 77.0 152.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.37 0 C-N-CA 123.505 0.722 . . . . 0.0 112.149 175.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 17.9 t70 70.99 85.85 0.13 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.086 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.25 134.28 44.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.549 -178.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.543 ' H ' ' HD2' ' A' ' 51' ' ' PRO . 50.3 t30 -167.8 -52.16 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.41 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.543 ' HD2' ' H ' ' A' ' 50' ' ' ASN . 61.3 Cg_endo -73.75 53.67 2.83 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 121.929 1.752 . . . . 0.0 112.461 178.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.25 35.62 2.05 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.747 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -160.18 100.88 1.41 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.695 179.033 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 5.5 Cg_exo . . . . . 0 C--O 1.248 1.008 0 C-N-CA 123.279 2.652 . . . . 0.0 112.278 -176.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.802 0 N-CA-C 112.249 -0.34 . . . . 0.0 112.249 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.4 -82.15 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.114 0.566 . . . . 0.0 111.68 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.4 122.71 48.48 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.977 0.417 . . . . 0.0 110.904 -177.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.08 101.16 6.16 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.872 176.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.531 ' H ' ' HG3' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -71.85 154.47 41.24 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.135 179.441 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 62.89 54.14 2.28 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.231 0.539 . . . . 0.0 110.026 -176.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.1 ptt-85 -107.78 23.78 13.95 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.772 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -86.41 54.53 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.047 -178.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -104.05 119.22 38.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.22 -178.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.15 65.65 4.09 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.969 -0.634 . . . . 0.0 111.985 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -101.9 -51.63 3.37 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.391 0.615 . . . . 0.0 110.513 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.58 170.79 5.77 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.318 -176.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.525 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 72.4 Cg_exo -52.53 168.62 0.42 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.137 2.558 . . . . 0.0 112.033 168.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -64.89 -38.36 90.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.165 -173.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.73 -27.04 71.48 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.056 -0.593 . . . . 0.0 113.05 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.525 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 94.2 m95 -85.21 141.94 29.79 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -176.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -124.29 138.75 54.36 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.92 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.7 HE21 ' HE1' ' A' ' 28' ' ' PHE . 8.7 tt0 -88.08 100.6 13.06 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.265 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -100.96 172.23 7.15 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.506 -178.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 m -134.25 134.69 42.27 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.33 174.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.6 -174.28 5.19 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.527 -175.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.429 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -70.58 -31.58 68.64 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.311 -177.44 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -76.17 -25.65 55.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.36 0.6 . . . . 0.0 109.903 178.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 105.95 12.07 26.75 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.769 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.97 144.19 30.16 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 174.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.1 p -86.94 153.87 3.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-O 121.145 0.498 . . . . 0.0 110.25 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -159.41 156.69 28.87 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.171 178.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.7 ' HE1' HE21 ' A' ' 18' ' ' GLN . 11.3 m-85 -113.18 132.72 55.37 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.012 -175.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.645 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -125.41 123.54 65.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-O 121.474 0.654 . . . . 0.0 111.169 -179.145 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.622 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 12.1 t0 -77.38 133.57 38.66 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.528 172.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.4 m-70 -100.84 -2.84 31.11 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 120.711 0.291 . . . . 0.0 111.271 -174.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.2 mt -88.09 -61.72 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 120.899 0.381 . . . . 0.0 110.304 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.524 ' C ' ' HG2' ' A' ' 34' ' ' LYS . 3.1 p30 -106.91 23.25 14.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.102 0.477 . . . . 0.0 110.615 178.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.622 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.0 OUTLIER 38.1 75.38 0.07 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.799 1.24 . . . . 0.0 113.894 173.499 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.477 ' HD3' ' CH2' ' A' ' 16' ' ' TRP . 0.0 OUTLIER -122.23 119.41 31.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.715 0.293 . . . . 0.0 110.401 172.944 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.645 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -99.83 113.99 26.87 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.195 178.01 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.54 HG21 ' HB3' ' A' ' 41' ' ' PRO . 1.7 t -126.33 132.87 51.52 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.391 0.139 . . . . 0.0 110.735 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -76.6 -26.89 55.48 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.212 0.53 . . . . 0.0 110.306 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.26 168.82 8.93 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.357 -178.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.512 ' OD2' ' HG ' ' A' ' 43' ' ' LEU . 13.5 t70 -63.54 125.92 88.45 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.052 -176.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.54 ' HB3' HG21 ' A' ' 37' ' ' THR . 93.5 Cg_endo -88.79 35.71 0.39 Allowed 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 123.367 2.712 . . . . 0.0 112.623 -178.102 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -127.82 -31.58 2.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.848 179.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.512 ' HG ' ' OD2' ' A' ' 40' ' ' ASP . 11.6 mt -50.96 -71.63 0.06 Allowed 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.728 0.643 . . . . 0.0 111.966 -176.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -104.93 8.38 34.56 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.064 0.459 . . . . 0.0 110.865 -178.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -102.52 24.31 10.6 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.62 -177.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.79 -102.44 0.37 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.19 178.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.11 -44.34 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.058 176.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.1 30.55 20.0 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.373 177.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -156.75 34.64 0.3 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.666 177.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.551 ' HB3' ' HD3' ' A' ' 51' ' ' PRO . 4.6 t-20 -123.66 -50.79 0.04 OUTLIER Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.692 -177.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.551 ' HD3' ' HB3' ' A' ' 50' ' ' ASN . 24.9 Cg_exo -63.77 -90.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.017 1.812 . . . . 0.0 112.109 177.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.471 ' H ' ' HB2' ' A' ' 51' ' ' PRO . 1.8 m -140.77 99.48 3.62 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.03 0.443 . . . . 0.0 110.676 177.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.8 -47.18 1.79 Allowed Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.263 176.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo . . . . . 0 C--N 1.358 1.065 0 C-N-CA 121.949 1.766 . . . . 0.0 111.924 175.584 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 N-CA-C 111.776 -0.529 . . . . 0.0 111.776 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.16 2.91 56.31 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -177.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -88.58 26.78 1.4 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.805 0.336 . . . . 0.0 111.636 -175.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.89 6.37 39.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.622 178.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.9 mtt85 72.45 167.68 0.31 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.094 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -89.72 50.11 1.84 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.075 0.464 . . . . 0.0 110.592 -177.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -85.24 61.67 7.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.204 -177.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.4 p -124.2 94.2 2.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.876 0.846 . . . . 0.0 110.587 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -99.86 62.59 1.16 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.95 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.68 -54.78 4.96 Favored Glycine 0 N--CA 1.451 -0.33 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.684 -175.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.59 ' HA ' HH21 ' A' ' 42' ' ' ARG . 2.6 t70 -92.47 -167.2 1.7 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 176.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.41 ' CD2' ' HD2' ' A' ' 41' ' ' PRO . 0.5 OUTLIER -78.78 168.97 22.87 Favored Pre-proline 0 C--N 1.317 -0.819 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.988 175.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.59 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 42.9 Cg_exo -56.53 158.11 16.9 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 121.874 1.716 . . . . 0.0 110.911 169.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -36.73 70.01 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.101 -0.499 . . . . 0.0 112.072 -171.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.32 -30.37 75.3 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.877 -0.677 . . . . 0.0 113.249 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.638 ' HZ3' HG22 ' A' ' 37' ' ' THR . 86.6 m95 -81.39 130.38 35.02 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -173.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.426 ' OE1' ' HA ' ' A' ' 17' ' ' GLU . 4.9 mm-40 -114.25 150.98 33.55 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.015 174.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -96.7 104.62 16.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.821 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.611 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 0.8 OUTLIER -115.63 166.2 12.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.137 0.494 . . . . 0.0 110.64 -176.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.03 139.89 53.4 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.587 174.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.453 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -81.3 -179.07 7.2 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.382 0.61 . . . . 0.0 110.713 -179.273 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.33 -11.51 60.73 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.013 -173.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.453 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 29.5 m-80 -101.81 -6.32 23.75 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.056 0.455 . . . . 0.0 110.252 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 91.12 16.11 54.56 Favored Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.969 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -89.46 125.45 35.18 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 175.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 6.0 p -75.89 150.96 6.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.471 0.653 . . . . 0.0 110.992 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 41.1 p90 -156.17 158.53 37.79 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.541 -1.208 . . . . 0.0 108.76 176.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -119.01 136.59 54.04 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.507 -176.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.633 ' HA ' ' O ' ' A' ' 35' ' ' ARG . 0.2 OUTLIER -133.27 124.28 48.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.482 0.658 . . . . 0.0 111.979 -176.509 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.451 ' HB2' ' CE2' ' A' ' 16' ' ' TRP . 50.4 t0 -74.05 109.58 7.66 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.308 171.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 43.2 m-70 -82.52 -1.54 50.81 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.07 0.462 . . . . 0.0 111.101 -175.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.8 mm -97.03 -52.94 8.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.835 176.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -90.7 -5.42 55.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.159 -178.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 62.15 61.29 1.35 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.455 176.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.633 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -123.8 118.94 28.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.688 177.102 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.526 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.01 109.41 21.4 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.483 176.433 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.638 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 8.8 t -123.85 136.76 54.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.189 0.519 . . . . 0.0 110.72 -178.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -83.71 5.2 25.52 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.257 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.44 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -112.32 152.89 28.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.77 0.319 . . . . 0.0 110.639 179.05 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.602 ' OD1' ' HG2' ' A' ' 42' ' ' ARG . 17.4 t0 -78.01 114.68 44.1 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.343 -174.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.472 ' HA ' ' CE1' ' A' ' 45' ' ' PHE . 5.6 Cg_exo -80.76 20.37 0.99 Allowed 'Trans proline' 0 CA--C 1.534 0.488 0 C-N-CA 123.667 2.912 . . . . 0.0 113.437 -179.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.602 ' HG2' ' OD1' ' A' ' 40' ' ' ASP . 3.1 ptp85 -108.57 -1.07 19.94 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.201 176.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mt -87.92 -79.95 0.28 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.857 0.361 . . . . 0.0 111.81 -176.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.78 11.36 6.04 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -172.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.472 ' CE1' ' HA ' ' A' ' 41' ' ' PRO . 5.6 m-85 -96.82 -15.14 21.44 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.409 0.623 . . . . 0.0 110.346 -179.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.33 75.81 8.28 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.765 178.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -76.47 59.16 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.091 0.472 . . . . 0.0 110.277 176.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -84.32 -44.74 13.51 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.198 -178.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -90.61 162.24 15.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.892 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.568 HD21 HG23 ' A' ' 52' ' ' THR . 12.9 t30 -83.59 120.17 74.94 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.439 -178.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -81.0 66.99 8.79 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.873 2.382 . . . . 0.0 112.488 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.568 HG23 HD21 ' A' ' 50' ' ' ASN . 0.0 OUTLIER -58.93 -70.63 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.803 177.563 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -171.03 130.29 0.78 Allowed Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.442 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo . . . . . 0 C--O 1.25 1.102 0 C-N-CA 122.657 2.238 . . . . 0.0 111.97 -179.458 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.636 0 N-CA-C 112.167 -0.373 . . . . 0.0 112.167 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.34 -38.01 5.84 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.909 0.385 . . . . 0.0 110.397 178.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.72 164.98 25.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.608 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.87 67.35 5.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.171 0.51 . . . . 0.0 110.813 -177.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.47 -24.91 17.11 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.313 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.9 mtpp 60.31 -107.08 0.29 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.293 178.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -165.58 -58.56 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.317 0.58 . . . . 0.0 109.525 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.0 t -131.14 117.98 39.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.225 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -122.7 10.9 9.71 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.27 0.557 . . . . 0.0 109.938 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.06 -123.35 6.31 Favored Glycine 0 N--CA 1.443 -0.884 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.563 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.403 ' HB3' ' H ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER -100.61 -88.89 0.35 Allowed 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 175.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.497 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 49.3 mt -89.77 161.49 38.64 Favored Pre-proline 0 N--CA 1.446 -0.643 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 168.104 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.588 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 49.9 Cg_exo -56.29 163.53 6.32 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 121.759 1.639 . . . . 0.0 110.925 174.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -55.6 -38.3 69.25 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.949 -170.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -76.29 -25.32 66.28 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.147 -0.549 . . . . 0.0 114.323 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.588 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 88.5 m95 -83.99 143.55 29.72 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -172.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.425 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -121.15 149.54 42.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.634 173.595 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -98.82 103.09 15.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.107 0.479 . . . . 0.0 109.769 179.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -105.31 167.22 9.88 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.143 -177.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.9 m -134.57 138.8 44.89 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.077 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.483 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -78.18 172.29 13.78 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 121.349 0.595 . . . . 0.0 109.47 178.185 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -72.47 -10.37 59.7 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.771 -172.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.483 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 35.5 m-80 -100.05 -1.59 36.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.265 0.555 . . . . 0.0 110.004 178.079 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 90.55 15.45 56.85 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.564 -0.744 . . . . 0.0 113.252 176.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -88.2 120.9 30.0 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 173.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -74.68 154.01 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.389 0.614 . . . . 0.0 110.829 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -160.75 155.26 23.51 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.293 176.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -113.12 136.98 52.12 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.951 -175.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.734 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.74 122.35 49.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.242 0.544 . . . . 0.0 111.087 -177.816 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.495 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -76.0 128.16 34.47 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 172.942 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.425 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 67.4 m-70 -99.05 15.07 27.03 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.806 0.336 . . . . 0.0 111.317 -175.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 21.9 mm -91.49 -55.52 6.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.085 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -120.64 3.01 10.69 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.5 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.0 OUTLIER 73.61 79.42 0.13 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.454 -0.793 . . . . 0.0 112.611 170.199 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.669 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -122.77 118.27 27.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.293 173.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.734 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -105.78 114.71 29.02 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.172 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.435 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 2.2 t -126.25 134.13 51.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.658 0.266 . . . . 0.0 110.772 -179.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -79.26 -17.83 53.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.142 0.496 . . . . 0.0 110.971 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.4 159.34 16.22 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.589 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.461 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 2.3 t70 -69.95 128.26 91.86 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.753 -176.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.473 ' HA ' ' CD1' ' A' ' 45' ' ' PHE . 2.7 Cg_exo -76.17 14.05 1.19 Allowed 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.289 2.66 . . . . 0.0 113.574 -175.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.28 -6.1 11.3 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 122.316 -0.24 . . . . 0.0 110.78 178.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.433 ' HG ' ' OD2' ' A' ' 40' ' ' ASP . 71.0 mt -83.92 -88.61 0.1 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.827 0.346 . . . . 0.0 111.295 -178.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -94.5 10.93 32.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.93 -176.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.473 ' CD1' ' HA ' ' A' ' 41' ' ' PRO . 50.4 m-85 -97.18 89.01 4.63 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.464 178.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -56.7 13.89 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.552 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 85.3 t -141.55 94.74 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.052 177.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -84.48 69.38 10.55 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.717 0.77 . . . . 0.0 109.643 176.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -159.26 -42.29 0.06 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.23 -177.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -113.01 143.85 29.95 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.767 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.35 -42.96 63.04 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.756 2.304 . . . . 0.0 112.705 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 58.5 44.1 18.42 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.803 0.811 . . . . 0.0 109.772 -175.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.796 ' HG2' ' HD2' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -149.06 150.37 32.02 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.153 -0.931 . . . . 0.0 109.786 -174.471 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.796 ' HD2' ' HG2' ' A' ' 53' ' ' LYS . 32.8 Cg_endo . . . . . 0 C--O 1.246 0.891 0 C-N-CA 122.227 1.951 . . . . 0.0 111.622 172.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.693 0 N-CA-C 111.862 -0.495 . . . . 0.0 111.862 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.71 142.67 51.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.852 0.358 . . . . 0.0 111.264 -178.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.04 71.62 0.76 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.85 176.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -82.51 55.97 3.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.62 -175.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -109.68 -175.11 2.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.834 -179.48 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.5 tptt -72.88 85.97 1.27 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.14 0.495 . . . . 0.0 109.702 175.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.518 ' HA ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -85.68 62.77 7.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.687 -175.482 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 1.03 ' HA ' ' HA ' ' A' ' 13' ' ' PRO . 3.4 m -101.45 150.22 6.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.67 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -106.53 10.64 31.2 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.324 0.583 . . . . 0.0 110.241 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 124.2 -91.46 0.43 Allowed Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.156 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -60.84 -78.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 175.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.553 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 84.2 mt -99.03 173.65 3.67 Favored Pre-proline 0 N--CA 1.449 -0.508 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.394 174.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 1.03 ' HA ' ' HA ' ' A' ' 8' ' ' VAL . 36.5 Cg_exo -63.63 177.4 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.393 2.062 . . . . 0.0 112.465 173.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.438 ' HB3' ' HG3' ' A' ' 7' ' ' ARG . 1.0 OUTLIER -58.39 -39.05 78.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.766 -171.769 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -90.99 -15.64 55.81 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.56 -0.829 . . . . 0.0 113.909 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.581 ' HZ3' HG22 ' A' ' 37' ' ' THR . 85.3 m95 -89.22 139.47 30.45 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -171.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -120.36 132.13 55.14 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.853 174.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -80.84 104.48 11.38 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 176.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.564 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.0 OUTLIER -114.93 164.5 14.05 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.371 -178.422 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 18.2 m -129.27 138.81 51.85 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.4 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.18 178.71 3.7 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.504 0.668 . . . . 0.0 110.946 -177.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.427 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -68.15 -19.94 64.85 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.864 -173.307 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -93.06 -43.81 8.7 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.443 -178.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 139.05 18.5 0.51 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.665 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.509 ' HB3' ' HE2' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -90.63 126.96 36.13 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 175.462 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -79.79 153.83 4.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 120.283 -0.567 . . . . 0.0 110.743 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.7 p90 -162.97 158.72 22.63 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.843 178.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -116.94 138.08 51.79 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.514 -177.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.619 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.8 124.35 53.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.364 0.602 . . . . 0.0 111.411 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -74.31 107.76 6.67 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 170.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -82.52 1.19 39.03 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.159 0.504 . . . . 0.0 111.117 -174.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.3 mm -97.73 -55.38 6.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.351 0.596 . . . . 0.0 109.623 176.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -92.56 -1.12 57.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.379 -176.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm 59.6 61.51 1.96 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.692 175.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.588 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -124.07 117.78 25.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.611 175.647 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.619 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -103.72 114.11 28.12 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.289 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.581 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 3.3 t -125.54 132.42 52.59 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.976 0.417 . . . . 0.0 110.746 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.509 ' HE2' ' HB3' ' A' ' 25' ' ' GLN . 26.0 m-85 -83.75 -4.91 59.01 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.764 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.583 HD12 ' H ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -115.54 172.08 7.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.436 175.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.583 ' H ' HD12 ' A' ' 39' ' ' LEU . 10.1 t70 -78.75 121.23 83.26 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.282 -174.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.457 ' O ' ' HB2' ' A' ' 45' ' ' PHE . 63.1 Cg_endo -94.81 7.24 2.2 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.155 2.57 . . . . 0.0 112.983 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -92.31 -14.49 28.72 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.311 -176.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.3 mt -70.24 -91.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.493 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -105.9 2.82 27.9 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -174.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 96.4 m-85 -91.97 15.79 12.47 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.326 -174.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.31 -11.31 14.88 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.844 0.354 . . . . 0.0 111.49 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.402 ' HB ' ' H ' ' A' ' 48' ' ' ASP . 0.0 OUTLIER -135.85 -146.3 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.165 -175.652 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.402 ' H ' ' HB ' ' A' ' 47' ' ' VAL . 1.2 t0 -86.96 -164.23 1.04 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.817 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -75.55 119.59 19.81 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.399 178.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.504 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 0.1 OUTLIER -77.15 126.35 85.41 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 179.093 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.504 ' HD3' ' HA ' ' A' ' 50' ' ' ASN . 31.1 Cg_endo -96.7 90.31 0.08 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.114 0 C-N-CA 123.426 2.751 . . . . 0.0 113.332 -178.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.5 15.38 11.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.751 0.786 . . . . 0.0 109.618 171.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.8 mtpt -105.69 149.21 37.65 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.334 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo . . . . . 0 C--O 1.249 1.066 0 C-N-CA 122.729 2.286 . . . . 0.0 112.169 177.769 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.825 0 N-CA-C 111.774 -0.53 . . . . 0.0 111.774 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.71 73.17 7.68 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.885 0.343 . . . . 0.0 110.846 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -77.07 -35.18 56.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.141 0.496 . . . . 0.0 110.512 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.39 72.21 10.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.197 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.2 ttm105 -81.82 133.33 35.32 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.515 -177.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.61 -178.97 6.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.779 173.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.43 88.67 0.9 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.492 0.663 . . . . 0.0 111.028 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.0 m -109.99 -11.96 11.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.651 176.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 66.66 -73.79 0.07 Allowed 'General case' 0 N--CA 1.467 0.41 0 O-C-N 123.939 0.775 . . . . 0.0 111.262 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -155.22 172.63 33.48 Favored Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 111.729 -0.549 . . . . 0.0 111.729 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -85.85 -4.48 59.18 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.286 0.565 . . . . 0.0 110.652 -179.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.666 HD11 ' HD1' ' A' ' 28' ' ' PHE . 43.9 mt -87.96 169.41 14.0 Favored Pre-proline 0 C--N 1.32 -0.714 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.436 -178.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.519 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 50.7 Cg_exo -59.39 173.9 1.27 Allowed 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 123.366 2.711 . . . . 0.0 112.348 170.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.4 -41.72 94.46 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.034 -175.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -74.48 -28.89 62.68 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.613 -177.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.544 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 91.6 m95 -83.84 134.53 34.7 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.252 0.549 . . . . 0.0 112.394 -173.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -119.35 143.09 47.59 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.563 174.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -94.34 106.76 18.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.922 0.391 . . . . 0.0 109.997 -177.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.572 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.5 mt-10 -114.85 167.8 10.46 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.373 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.2 m -124.29 136.63 54.27 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.173 175.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.1 177.32 9.03 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.099 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -64.92 -35.01 79.77 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.245 -176.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -67.05 -37.72 84.54 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.301 0.572 . . . . 0.0 109.82 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 116.6 15.96 6.68 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.343 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -87.69 137.69 32.12 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 173.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.9 p -84.26 145.5 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 120.015 -0.674 . . . . 0.0 109.938 178.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.533 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.2 p90 -147.18 155.49 42.16 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.502 -179.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.666 ' HD1' HD11 ' A' ' 12' ' ' LEU . 17.9 m-85 -114.35 132.17 56.29 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.872 -174.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.572 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -131.07 120.3 46.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-O 121.142 0.496 . . . . 0.0 110.85 -179.122 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.502 ' HB3' ' HD3' ' A' ' 35' ' ' ARG . 4.6 t0 -78.7 112.68 16.06 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 171.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.6 m-70 -82.82 -10.15 58.99 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.043 -172.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.0 mm -75.32 -56.54 8.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.943 ' HB2' ' HD2' ' A' ' 35' ' ' ARG . 61.9 m-80 -93.57 -5.08 49.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.599 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.5 mmtm 62.82 61.69 1.13 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.832 176.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.943 ' HD2' ' HB2' ' A' ' 33' ' ' ASN . 0.8 OUTLIER -122.74 123.34 40.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.56 176.3 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.56 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -105.23 117.41 33.93 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.692 179.809 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.537 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 1.8 t -125.49 130.97 52.84 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.892 0.377 . . . . 0.0 110.247 177.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.519 ' HA ' ' CB ' ' A' ' 27' ' ' PHE . 11.2 m-85 -78.53 -17.25 56.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.023 -177.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -112.88 166.47 11.36 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 120.87 0.366 . . . . 0.0 111.009 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -59.67 119.36 39.71 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.695 -177.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.528 ' HD3' ' CD2' ' A' ' 28' ' ' PHE . 97.4 Cg_endo -91.38 21.9 0.75 Allowed 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 123.236 2.624 . . . . 0.0 112.579 -179.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -118.44 2.18 11.82 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.929 0.395 . . . . 0.0 110.746 177.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.9 mt -77.95 -78.48 0.14 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.192 -177.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -97.91 8.77 44.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.09 0.471 . . . . 0.0 110.97 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.459 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 94.0 m-85 -100.61 61.64 1.02 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.37 0.605 . . . . 0.0 110.31 -177.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.05 179.21 7.64 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.32 -0.854 . . . . 0.0 108.884 177.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -80.79 56.53 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.498 0.666 . . . . 0.0 109.651 176.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -156.39 -178.61 7.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.608 -175.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -79.37 -68.09 0.69 Allowed 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 175.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 177.57 102.15 0.12 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.865 175.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -62.23 96.27 0.15 Allowed 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.679 2.253 . . . . 0.0 111.373 176.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -102.03 105.02 15.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.454 -174.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.452 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -108.02 119.04 51.22 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.848 177.226 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 22.7 Cg_exo . . . . . 0 C--O 1.249 1.061 0 C-N-CA 122.86 2.374 . . . . 0.0 112.186 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.664 0 N-CA-C 111.846 -0.502 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.5 m 56.33 -145.97 0.59 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.602 0.239 . . . . 0.0 110.832 -178.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -167.12 156.33 10.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.439 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.407 ' H ' ' HG3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -105.33 87.92 2.73 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.241 0.543 . . . . 0.0 109.543 175.349 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.49 -19.11 13.04 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.863 -177.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.32 73.25 10.16 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.784 -178.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -29.28 70.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.157 0.503 . . . . 0.0 110.028 175.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -94.77 72.36 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.613 174.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.79 138.28 41.09 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.981 -178.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -84.57 137.86 16.26 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.987 179.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -73.78 -177.21 2.69 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.922 0.391 . . . . 0.0 110.125 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.496 HD11 ' CD1' ' A' ' 28' ' ' PHE . 17.1 mt -96.01 156.74 36.79 Favored Pre-proline 0 C--N 1.313 -1.002 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.121 -171.091 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.501 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 76.8 Cg_exo -55.21 177.86 0.1 Allowed 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.6 2.867 . . . . 0.0 112.885 172.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -65.07 -43.12 93.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.54 -176.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.37 -28.94 72.02 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.249 -0.501 . . . . 0.0 112.613 -176.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.515 ' HZ3' HG22 ' A' ' 37' ' ' THR . 92.8 m95 -83.74 146.91 27.93 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -129.32 138.54 51.64 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.321 175.09 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -93.13 101.18 13.47 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.595 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 2.0 mt-10 -106.1 164.06 12.29 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.053 -178.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 12.7 m -125.65 134.28 51.92 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.018 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.419 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -73.67 172.94 10.5 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 121.269 0.556 . . . . 0.0 110.053 179.021 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.442 ' HG3' ' H ' ' A' ' 22' ' ' GLU . 0.3 OUTLIER -65.93 -27.14 67.95 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.484 -173.945 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.419 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 40.3 m-80 -76.98 -36.89 56.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.311 0.577 . . . . 0.0 109.68 177.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 126.79 7.6 5.07 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.891 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -78.02 116.43 18.5 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 176.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.2 p -74.14 154.76 6.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-O 121.176 0.513 . . . . 0.0 110.209 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.537 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 51.9 p90 -164.74 159.76 19.02 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.542 -0.753 . . . . 0.0 110.416 -177.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.496 ' CD1' HD11 ' A' ' 12' ' ' LEU . 6.9 m-85 -114.39 130.66 56.71 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.71 -176.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.595 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -130.93 127.57 61.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 121.174 0.512 . . . . 0.0 110.08 176.816 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.667 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -75.38 136.17 40.78 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 173.762 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.4 m-70 -107.63 28.67 7.94 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.26 0.553 . . . . 0.0 111.429 -176.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.3 mm -107.95 -54.91 5.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 171.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.49 ' O ' ' HB2' ' A' ' 34' ' ' LYS . 59.3 m-80 -95.13 -28.51 15.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.835 177.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.667 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 0.1 OUTLIER 79.49 53.21 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.237 174.12 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.38 131.76 54.77 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.448 174.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.55 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -96.5 125.81 41.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.852 -178.271 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.515 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 2.7 t -125.77 138.17 53.84 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.928 0.394 . . . . 0.0 110.104 175.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -89.16 -8.18 54.19 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.531 178.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.452 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -112.51 157.51 21.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.39 179.186 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.619 ' OD1' ' HB2' ' A' ' 42' ' ' ARG . 12.2 t70 -68.12 131.63 92.11 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.6 -177.091 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.545 ' O ' ' HB2' ' A' ' 45' ' ' PHE . 3.3 Cg_exo -77.25 5.05 5.35 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 122.928 2.418 . . . . 0.0 114.087 -175.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.619 ' HB2' ' OD1' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -76.41 -14.51 60.06 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 122.025 -0.422 . . . . 0.0 111.921 -178.369 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 mt -86.93 -82.26 0.21 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.828 0.347 . . . . 0.0 111.6 -176.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.33 -0.33 54.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.254 0.55 . . . . 0.0 112.093 -172.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.545 ' HB2' ' O ' ' A' ' 41' ' ' PRO . 20.0 m-85 -117.51 -3.31 11.37 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.294 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.467 ' HB ' ' H ' ' A' ' 47' ' ' VAL . 0.2 OUTLIER 57.0 -114.12 0.8 Allowed 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.022 -176.463 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.467 ' H ' ' HB ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -152.95 122.37 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.831 0.348 . . . . 0.0 110.58 179.069 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -92.91 20.25 6.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.296 0.57 . . . . 0.0 110.044 176.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -105.07 -83.37 0.51 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.361 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -143.44 128.84 9.92 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.908 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -81.89 -26.29 3.08 Favored 'Trans proline' 0 CA--C 1.533 0.459 0 C-N-CA 122.866 2.377 . . . . 0.0 113.97 -175.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.7 m 65.8 86.24 0.13 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.167 0.508 . . . . 0.0 110.896 -173.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.37 126.55 35.66 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.963 -179.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo . . . . . 0 C--O 1.252 1.181 0 C-N-CA 122.59 2.193 . . . . 0.0 112.58 179.464 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.25 14.04 8.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.981 0.42 . . . . 0.0 111.559 -178.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -87.46 -67.69 0.8 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.937 0.399 . . . . 0.0 110.17 177.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -126.76 74.41 1.48 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.392 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.7 ttt-85 -75.48 100.5 4.53 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 175.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -76.63 6.11 6.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.634 -175.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.446 HH11 ' HD3' ' A' ' 7' ' ' ARG . 9.4 mtt-85 -118.33 85.11 2.29 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 174.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.36 53.31 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.1 -175.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.6 50.24 1.62 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.321 0.582 . . . . 0.0 110.561 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -88.05 143.82 18.35 Favored Glycine 0 N--CA 1.447 -0.603 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.498 -176.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.49 134.47 50.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.533 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 24.3 mt -85.75 152.69 57.24 Favored Pre-proline 0 C--N 1.318 -0.798 0 CA-C-O 120.926 0.393 . . . . 0.0 111.474 -176.265 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.535 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 32.6 Cg_exo -61.27 169.87 5.85 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.167 2.578 . . . . 0.0 112.515 174.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.59 -40.03 62.23 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.335 -0.848 . . . . 0.0 113.169 -173.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -83.33 -12.3 78.93 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.39 -0.909 . . . . 0.0 113.68 -175.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.615 ' HZ3' HG22 ' A' ' 37' ' ' THR . 87.6 m95 -92.27 137.97 31.92 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -172.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -120.45 141.69 49.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.542 174.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.764 HE21 ' HE1' ' A' ' 28' ' ' PHE . 20.4 tt0 -92.84 104.2 16.48 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.552 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.7 mt-10 -114.67 168.63 9.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.648 -176.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.24 140.57 51.86 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.205 176.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.468 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -77.53 -176.56 4.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.191 0.52 . . . . 0.0 110.349 179.846 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.7 -26.37 66.14 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.427 -176.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.468 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 16.6 m-80 -84.44 -43.16 14.91 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.083 0.468 . . . . 0.0 110.842 -178.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 131.2 16.5 1.54 Allowed Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.906 -0.664 . . . . 0.0 111.854 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.0 126.96 35.64 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 174.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -80.05 152.1 4.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.352 0.596 . . . . 0.0 110.849 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.552 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 54.1 p90 -157.63 166.03 33.94 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.704 -178.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.764 ' HE1' HE21 ' A' ' 18' ' ' GLN . 7.7 m-85 -118.34 134.96 54.61 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.703 -179.061 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.549 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -129.45 124.94 60.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-O 121.138 0.494 . . . . 0.0 111.0 -179.828 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.611 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 2.6 t0 -73.56 114.06 11.38 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 171.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -86.99 0.27 55.45 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.749 -0.38 . . . . 0.0 112.012 -172.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -79.42 -49.51 19.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -101.16 -11.39 19.59 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.279 -178.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.67 58.98 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.181 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.611 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -122.29 125.68 46.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.689 179.27 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -96.93 129.35 44.39 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.001 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.615 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 7.1 t -125.51 132.22 52.67 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 172.263 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -93.02 0.05 57.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.453 0.644 . . . . 0.0 109.998 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.869 HD21 ' HG ' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -116.65 159.53 22.06 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.26 173.44 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.644 ' OD1' ' HB2' ' A' ' 42' ' ' ARG . 16.1 t70 -69.59 131.47 89.78 Favored Pre-proline 0 C--N 1.319 -0.731 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.653 -174.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.664 ' HA ' ' CD1' ' A' ' 45' ' ' PHE . 8.0 Cg_exo -74.79 29.83 0.35 Allowed 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 123.335 2.69 . . . . 0.0 114.021 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.644 ' HB2' ' OD1' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -105.59 -21.94 13.09 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 122.325 -0.234 . . . . 0.0 110.883 174.614 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.869 ' HG ' HD21 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -66.7 -93.24 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.837 -174.304 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -85.1 8.76 16.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.233 0.54 . . . . 0.0 111.187 -175.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.664 ' CD1' ' HA ' ' A' ' 41' ' ' PRO . 15.4 m-85 -104.21 1.97 31.19 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.86 -177.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.644 HG22 ' H ' ' A' ' 48' ' ' ASP . 23.8 m -138.61 135.91 35.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.943 178.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 35.9 m -99.35 15.45 4.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.971 0.415 . . . . 0.0 111.276 -177.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.644 ' H ' HG22 ' A' ' 46' ' ' THR . 32.9 t0 -130.65 165.74 22.18 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.274 -178.434 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -66.62 -34.95 79.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.464 0.649 . . . . 0.0 109.77 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -133.8 118.26 14.35 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.753 176.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.401 ' HG3' ' HG3' ' A' ' 42' ' ' ARG . 13.8 Cg_endo -59.01 142.54 99.51 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.563 2.175 . . . . 0.0 111.901 177.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.51 108.29 1.62 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.347 -177.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.2 tttm -108.87 130.26 22.94 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.853 -178.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo . . . . . 0 C--O 1.251 1.136 0 C-N-CA 123.112 2.541 . . . . 0.0 111.835 176.777 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 N-CA-C 111.742 -0.543 . . . . 0.0 111.742 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.87 -42.13 61.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.948 0.404 . . . . 0.0 110.87 -177.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.41 132.63 40.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.446 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.8 mttp -123.1 77.65 1.49 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.212 0.53 . . . . 0.0 110.01 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 8.9 mtm180 -77.82 147.13 35.36 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.442 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -92.98 7.68 43.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.51 -176.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.95 46.64 0.64 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.531 177.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -143.22 156.61 17.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.295 174.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.09 -69.48 0.5 Allowed 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.431 -175.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.15 -49.83 3.84 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.709 -178.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -63.73 -44.91 92.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.276 0.56 . . . . 0.0 109.612 173.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.403 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 7.9 mt -87.34 160.93 47.35 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.272 176.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.55 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 52.9 Cg_exo -56.17 173.26 0.46 Allowed 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.844 2.362 . . . . 0.0 112.251 172.115 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -61.46 -39.38 90.66 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.837 -173.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -75.92 -24.7 68.7 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.919 -0.657 . . . . 0.0 114.062 -175.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.55 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 88.2 m95 -82.42 138.2 34.49 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -171.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.445 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -118.19 153.56 33.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.834 175.369 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.425 HE21 HG21 ' A' ' 26' ' ' VAL . 45.6 tt0 -107.79 106.63 17.01 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.468 178.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.513 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 1.1 mt-10 -110.78 178.55 4.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.436 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.19 138.13 53.62 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.477 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.525 ' OD1' ' HG3' ' A' ' 22' ' ' GLU . 0.8 OUTLIER -107.86 179.24 4.28 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 -179.056 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.525 ' HG3' ' OD1' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -26.4 -78.6 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -166.767 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -88.35 35.44 0.76 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.166 0.507 . . . . 0.0 111.915 -170.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.51 4.84 89.97 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.888 -0.672 . . . . 0.0 111.486 178.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -61.14 113.93 2.85 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.36 -0.42 . . . . 0.0 109.917 177.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.425 HG21 HE21 ' A' ' 18' ' ' GLN . 1.3 p -78.7 153.25 4.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.201 0.524 . . . . 0.0 110.752 -179.169 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.513 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 53.9 p90 -157.94 161.18 38.19 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.906 177.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.455 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 15.2 m-85 -116.97 137.13 52.42 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.089 -175.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.511 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.2 OUTLIER -129.54 121.03 52.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.342 0.591 . . . . 0.0 111.344 -178.652 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.717 ' HB3' ' HG2' ' A' ' 35' ' ' ARG . 43.0 t0 -78.31 117.22 19.34 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.722 -1.127 . . . . 0.0 108.958 177.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.445 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 73.7 m-70 -89.39 -4.07 58.19 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.815 0.34 . . . . 0.0 111.17 -176.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 17.7 mm -95.79 -42.79 12.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.195 0.521 . . . . 0.0 110.048 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.525 ' CB ' ' HD3' ' A' ' 35' ' ' ARG . 69.5 m-80 -98.13 -7.43 29.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.002 -179.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.01 51.59 2.8 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.404 173.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.717 ' HG2' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -125.9 142.3 51.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.679 0.276 . . . . 0.0 111.472 177.026 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.511 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -111.15 119.17 38.07 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.262 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.548 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 15.3 t -125.25 137.7 54.1 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.056 0.455 . . . . 0.0 110.891 178.576 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -91.65 3.81 54.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.898 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.92 163.92 16.84 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.832 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.511 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 2.7 t70 -70.79 122.54 87.1 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.567 -177.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.511 ' HD3' ' HA ' ' A' ' 40' ' ' ASP . 9.1 Cg_endo -89.99 32.74 0.35 Allowed 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 123.23 2.62 . . . . 0.0 112.687 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -115.99 -41.86 3.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.726 -0.216 . . . . 0.0 110.724 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 7.1 mt -55.96 -81.06 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.475 -178.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -106.12 13.28 29.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.115 0.483 . . . . 0.0 111.686 -174.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -103.86 71.75 1.07 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.887 -177.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -83.9 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.338 176.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.1 p -118.26 113.48 42.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 173.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -103.97 70.76 1.01 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.443 0.639 . . . . 0.0 110.852 -173.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -98.69 76.05 2.18 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.469 176.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -173.59 156.02 2.69 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -65.65 91.68 0.24 Allowed 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.147 1.898 . . . . 0.0 111.728 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.08 113.92 5.43 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.212 0.53 . . . . 0.0 111.121 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.479 ' HB3' ' HE3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -81.68 128.0 70.76 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.524 -179.815 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo . . . . . 0 C--O 1.25 1.124 0 C-N-CA 122.544 2.163 . . . . 0.0 111.603 175.947 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.729 0 N-CA-C 111.511 -0.636 . . . . 0.0 111.511 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.89 116.31 22.14 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.62 0.21 . . . . 0.0 110.461 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.62 122.4 26.47 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 176.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.3 mttt -80.51 -72.34 0.42 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.87 -176.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.0 mtt180 63.15 -86.68 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.171 0 O-C-N 123.558 0.536 . . . . 0.0 110.653 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.481 ' HA ' ' HB3' ' A' ' 9' ' ' ALA . 3.3 ptmt 49.89 22.67 0.89 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.208 1.003 . . . . 0.0 113.321 177.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.57 -58.51 3.86 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.328 0.585 . . . . 0.0 109.525 175.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.14 28.48 3.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.096 174.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.481 ' HB3' ' HA ' ' A' ' 6' ' ' LYS . . . -123.19 171.01 9.66 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.302 -177.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -75.31 154.34 45.93 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.492 -178.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -81.75 -16.3 51.52 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.227 0.537 . . . . 0.0 110.888 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.789 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 0.3 OUTLIER -88.39 165.67 27.2 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.78 -169.835 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.451 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 47.4 Cg_exo -60.6 -168.73 0.05 OUTLIER 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.826 3.017 . . . . 0.0 112.475 169.376 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.45 -45.32 72.83 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.011 -174.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -82.02 -21.96 60.19 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.64 -0.791 . . . . 0.0 113.157 -175.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.789 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 85.6 m95 -83.28 144.89 29.42 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -171.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.416 ' HB2' ' HD2' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -124.73 146.83 48.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.115 174.185 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.503 ' HB2' ' CD2' ' A' ' 12' ' ' LEU . 28.0 tt0 -100.6 100.96 11.75 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.618 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 5.0 mt-10 -108.91 168.17 9.55 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.102 0.477 . . . . 0.0 110.99 -175.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -114.28 137.62 51.56 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.549 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -176.14 4.92 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.097 0.475 . . . . 0.0 110.677 -179.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -70.45 -30.0 66.72 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.248 -175.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -78.34 -43.77 26.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.185 0.517 . . . . 0.0 109.764 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 128.74 25.78 0.99 Allowed Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.998 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.7 149.36 23.4 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 174.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.406 HG21 HE21 ' A' ' 18' ' ' GLN . 1.4 p -90.49 156.07 3.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.35 0.595 . . . . 0.0 110.653 -179.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 46.0 p90 -161.05 163.72 31.37 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.592 178.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.689 ' CD1' HD21 ' A' ' 12' ' ' LEU . 14.3 m-85 -117.2 131.42 56.87 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.484 -176.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.642 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.46 122.04 46.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.329 0.585 . . . . 0.0 110.791 179.519 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.549 ' HA ' ' HA ' ' A' ' 16' ' ' TRP . 0.0 OUTLIER -77.83 126.62 31.12 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 172.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.416 ' HD2' ' HB2' ' A' ' 17' ' ' GLU . 64.5 m-70 -99.56 9.5 43.08 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.39 -174.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.5 mm -94.2 -49.34 12.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.093 0.473 . . . . 0.0 109.891 175.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -108.96 -1.52 18.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.648 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm 64.72 65.41 0.62 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 170.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.588 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -123.72 134.12 53.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.565 0.222 . . . . 0.0 111.094 173.856 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.642 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -112.1 118.75 36.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.664 179.413 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.499 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 1.8 t -125.98 136.84 53.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.775 0.321 . . . . 0.0 110.517 176.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -87.28 -7.23 58.08 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.062 0.458 . . . . 0.0 110.659 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.43 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -113.8 164.42 13.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.759 176.249 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.524 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 9.7 t70 -63.73 128.04 92.29 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.858 -176.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.524 ' HD3' ' HA ' ' A' ' 40' ' ' ASP . 6.3 Cg_exo -73.82 -13.89 24.21 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 122.774 2.316 . . . . 0.0 113.22 -174.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.8 mtm180 -87.45 12.31 12.51 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.686 -173.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.3 mt -79.11 -82.72 0.1 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.754 177.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -102.54 -0.07 32.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.122 0.487 . . . . 0.0 111.204 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -119.0 -172.2 2.25 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.361 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.7 m 60.04 54.14 4.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.685 176.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.76 84.99 2.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.19 -60.62 2.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.316 -173.245 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -128.53 176.27 7.89 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.43 -177.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.2 t30 -103.62 125.33 35.11 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 116.297 -0.411 . . . . 0.0 109.969 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -55.07 134.47 63.94 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 123.09 2.526 . . . . 0.0 112.775 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.8 134.17 54.43 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.28 177.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.421 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 2.1 mttm -67.87 132.12 92.38 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.78 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 2.6 Cg_exo . . . . . 0 C--O 1.248 1.021 0 C-N-CA 122.977 2.451 . . . . 0.0 111.598 176.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.822 0 N-CA-C 111.642 -0.583 . . . . 0.0 111.642 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.87 95.29 0.68 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.896 0.348 . . . . 0.0 110.143 177.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -82.11 51.97 1.89 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.749 -173.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.4 122.57 43.37 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 175.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -10.53 59.52 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.102 -174.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.64 -122.53 0.94 Allowed 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.389 -175.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? 53.98 37.63 27.16 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.111 0.482 . . . . 0.0 110.715 177.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.52 ' HB ' ' HG3' ' A' ' 13' ' ' PRO . 13.8 m -85.6 104.21 13.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.653 0.739 . . . . 0.0 110.418 -176.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.04 119.48 24.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.493 -175.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 111.92 -150.67 18.1 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.429 176.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.406 ' HB3' ' H ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -88.11 -87.54 0.15 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 175.765 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.474 HD11 ' HB2' ' A' ' 18' ' ' GLN . 14.5 mt -86.67 135.0 36.42 Favored Pre-proline 0 N--CA 1.427 -1.596 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 169.014 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.535 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 26.9 Cg_exo -63.15 168.26 11.16 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.479 2.119 . . . . 0.0 112.065 178.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.53 -39.45 80.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.688 -174.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -80.22 -20.79 66.39 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.553 -0.832 . . . . 0.0 113.047 -176.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.535 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 79.8 m95 -86.24 138.95 31.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.402 0.62 . . . . 0.0 112.36 -176.362 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -122.8 143.59 49.74 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.011 175.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.474 ' HB2' HD11 ' A' ' 12' ' ' LEU . 8.4 tt0 -93.42 110.55 22.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.074 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.657 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 2.3 mt-10 -119.92 165.28 14.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.515 -178.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.3 m -121.61 133.89 55.0 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.573 177.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.77 -177.8 6.81 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.255 0.55 . . . . 0.0 111.075 -176.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.97 -18.06 62.02 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.931 -174.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -88.5 -8.36 54.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.339 0.59 . . . . 0.0 109.563 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.1 19.05 58.24 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.06 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -97.44 135.63 39.03 Favored 'General case' 0 N--CA 1.438 -1.038 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 176.194 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.0 p -78.47 151.01 5.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.717 0.77 . . . . 0.0 111.084 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.657 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 50.8 p90 -150.84 160.85 43.61 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.135 177.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -116.55 137.93 51.8 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.571 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -132.53 126.52 55.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 CA-C-O 121.294 0.568 . . . . 0.0 111.492 -179.079 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.561 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 4.8 t70 -77.33 123.61 26.73 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.914 -1.039 . . . . 0.0 108.46 172.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 73.1 m-70 -98.73 9.11 44.06 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.322 -175.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 13.6 mm -91.27 -57.03 4.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.911 178.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.61 1.5 19.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.177 178.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 12.2 mptt 67.03 72.47 0.36 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.317 -0.856 . . . . 0.0 113.084 168.381 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.2 OUTLIER -123.84 120.31 32.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.573 172.172 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.571 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -97.57 117.1 31.07 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.235 176.309 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.524 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 2.7 t -125.63 131.9 52.58 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.856 0.36 . . . . 0.0 110.761 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -79.87 -15.7 56.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.373 0.606 . . . . 0.0 109.699 178.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.47 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER -102.52 161.5 13.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.834 -178.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.601 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 55.5 t0 -75.96 118.24 69.71 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.349 -175.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -90.66 20.84 0.92 Allowed 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.774 2.316 . . . . 0.0 112.443 176.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.53 ' HB3' HH11 ' A' ' 42' ' ' ARG . 1.3 ttp-105 -115.92 -8.25 11.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.544 175.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.601 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 27.8 mt -51.47 -72.62 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.892 -0.594 . . . . 0.0 112.037 -176.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -104.81 31.52 4.72 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.415 0.626 . . . . 0.0 110.663 -178.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -109.23 -78.32 0.59 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.483 -177.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.401 ' HB ' ' CG2' ' A' ' 8' ' ' VAL . 3.5 m -142.23 97.58 3.15 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.573 178.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 3.4 p -107.86 0.75 9.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.242 0.544 . . . . 0.0 110.147 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -91.46 7.74 39.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.372 -177.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.7 t70 73.3 -57.99 0.61 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.622 0.769 . . . . 0.0 112.362 173.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 58.11 70.34 1.28 Allowed Pre-proline 0 N--CA 1.468 0.436 0 C-N-CA 122.657 0.383 . . . . 0.0 111.069 -179.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -84.3 -12.86 7.76 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.853 2.368 . . . . 0.0 112.825 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.97 160.54 29.08 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.943 -174.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.4 ttpm? -128.6 78.86 75.28 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.292 174.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo . . . . . 0 C--O 1.247 0.949 0 C-N-CA 123.171 2.581 . . . . 0.0 112.494 -177.096 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.649 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -91.12 -17.36 26.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.03 0.443 . . . . 0.0 110.323 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -69.52 104.93 2.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.204 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.31 -79.96 0.37 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 73.0 -49.65 0.7 Allowed 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.49 0.716 . . . . 0.0 112.347 173.065 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.32 108.49 3.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.222 0.534 . . . . 0.0 111.811 -175.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.43 ' NH2' ' HB2' ' A' ' 11' ' ' ASP . 0.4 OUTLIER -84.05 65.82 8.91 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.941 177.305 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 1.4 p -78.48 -44.58 26.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.875 -175.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -145.55 177.99 8.45 Favored 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 110.383 -0.229 . . . . 0.0 110.383 -177.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.28 131.55 52.11 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.696 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.43 ' HB2' ' NH2' ' A' ' 7' ' ' ARG . 1.6 t70 -98.12 179.64 4.69 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.117 0.485 . . . . 0.0 110.436 -178.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.407 HD11 ' CD1' ' A' ' 28' ' ' PHE . 0.8 OUTLIER -97.45 169.08 9.1 Favored Pre-proline 0 C--N 1.314 -0.962 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.615 -175.509 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.502 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 72.9 Cg_exo -54.75 173.65 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 123.17 2.58 . . . . 0.0 112.551 170.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -65.15 -39.84 93.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.196 -174.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.15 -28.82 73.21 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.398 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.544 ' HZ3' HG22 ' A' ' 37' ' ' THR . 89.6 m95 -83.66 122.0 28.03 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.935 0.716 . . . . 0.0 112.935 -174.271 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -101.87 130.51 48.36 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.009 174.131 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.467 HE21 HG21 ' A' ' 26' ' ' VAL . 54.4 tt0 -85.01 100.19 11.5 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.039 0.447 . . . . 0.0 110.191 177.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.606 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 2.0 mm-40 -106.91 173.62 6.24 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.732 -176.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 8.0 m -126.39 139.45 53.26 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.241 175.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.473 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -83.74 177.51 8.33 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.17 0.51 . . . . 0.0 110.296 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.503 ' H ' ' HG3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -70.71 -23.69 62.51 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.368 -174.978 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.473 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 41.1 m-80 -83.96 -11.28 57.08 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.241 0.543 . . . . 0.0 110.39 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 95.48 12.51 53.82 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.473 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -81.57 139.56 35.0 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 174.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.467 HG21 HE21 ' A' ' 18' ' ' GLN . 0.8 OUTLIER -86.45 149.37 4.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.854 176.819 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.431 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 44.1 p90 -157.54 158.13 35.08 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.095 -0.957 . . . . 0.0 109.984 -179.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.407 ' CD1' HD11 ' A' ' 12' ' ' LEU . 10.5 m-85 -114.97 131.98 56.73 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.205 -175.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.612 ' HB ' ' CG2' ' A' ' 36' ' ' THR . 0.1 OUTLIER -129.35 120.53 51.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-O 121.614 0.721 . . . . 0.0 111.113 178.532 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.41 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 38.2 t0 -73.01 120.72 19.03 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.545 173.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -93.75 1.38 56.53 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.897 0.38 . . . . 0.0 110.463 -178.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.2 mm -101.81 -51.92 8.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.382 0.611 . . . . 0.0 109.632 175.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -89.11 -11.18 44.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.725 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.411 ' HD2' ' HA ' ' A' ' 34' ' ' LYS . 2.6 mmmm 62.64 57.08 1.87 Allowed 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.266 0.626 . . . . 0.0 112.564 175.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.57 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -124.57 125.68 44.57 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.303 175.638 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.612 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -102.08 115.64 30.98 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 174.562 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.544 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 1.6 t -126.09 134.44 51.37 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.803 0.335 . . . . 0.0 110.581 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -84.2 -4.38 58.78 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.04 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -121.61 166.7 13.83 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.96 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -68.91 125.39 91.88 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.901 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.63 ' O ' HD23 ' A' ' 43' ' ' LEU . 85.3 Cg_endo -90.78 -144.68 0.02 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.832 0 C-N-CA 122.513 2.142 . . . . 0.0 110.572 173.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.484 ' H ' ' HB2' ' A' ' 41' ' ' PRO . 0.0 OUTLIER 64.56 -22.05 0.07 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 179.708 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.63 HD23 ' O ' ' A' ' 41' ' ' PRO . 0.3 OUTLIER -60.81 -89.42 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.2 0.524 . . . . 0.0 111.392 -179.312 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -105.03 4.98 32.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.665 0.745 . . . . 0.0 110.674 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.449 ' CD2' ' HA ' ' A' ' 41' ' ' PRO . 0.0 OUTLIER -117.51 39.48 3.3 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.859 -177.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.51 -61.52 1.95 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.074 -0.966 . . . . 0.0 112.135 -175.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 4.6 p -94.24 75.55 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.689 0.757 . . . . 0.0 111.686 -172.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.0 t70 68.39 -73.35 0.09 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 114.627 -1.17 . . . . 0.0 113.545 169.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -69.55 126.64 30.34 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -164.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.415 ' ND2' ' HD2' ' A' ' 51' ' ' PRO . 18.2 t-20 -174.23 133.99 0.56 Allowed Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 114.241 -1.345 . . . . 0.0 108.133 173.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.415 ' HD2' ' ND2' ' A' ' 50' ' ' ASN . 1.7 Cg_endo -43.07 102.02 0.04 OUTLIER 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.737 2.958 . . . . 0.0 112.999 -178.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.66 85.08 2.11 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.202 -178.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.0 107.82 47.33 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.798 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo . . . . . 0 C--O 1.25 1.084 0 C-N-CA 122.985 2.456 . . . . 0.0 111.26 176.961 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.851 0 N-CA-C 111.997 -0.441 . . . . 0.0 111.997 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 m -80.8 65.86 6.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.01 0.433 . . . . 0.0 111.381 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.39 64.27 8.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.551 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -128.9 63.66 1.47 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.663 179.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 71.68 136.97 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 O-C-N 123.928 0.767 . . . . 0.0 110.837 -175.35 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.6 mtmt -120.33 161.47 21.09 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.567 -176.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.7 ttm-85 64.01 46.75 3.64 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.765 -179.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.97 49.76 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.073 -179.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 76.1 156.01 0.17 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.445 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -156.9 74.04 0.23 Allowed Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.12 -14.48 57.66 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.012 0.434 . . . . 0.0 111.673 -174.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 19.9 mt -83.61 156.12 65.26 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.025 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.553 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 51.0 Cg_exo -57.28 168.33 2.86 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 122.911 2.408 . . . . 0.0 112.312 174.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.86 -39.23 68.41 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.736 -0.665 . . . . 0.0 112.212 -174.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -77.98 -22.73 68.08 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.4 -176.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.553 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 92.0 m95 -88.41 131.0 35.03 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -173.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.415 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 15.7 mm-40 -112.61 140.06 47.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.34 174.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.704 HE21 ' HE1' ' A' ' 28' ' ' PHE . 32.3 tt0 -93.27 104.16 16.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.028 0.442 . . . . 0.0 110.164 179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.618 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 4.1 mt-10 -109.81 168.45 9.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.713 -177.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.8 m -125.63 134.02 52.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.127 175.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.412 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -79.13 -176.51 5.16 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.188 0.518 . . . . 0.0 110.865 -177.56 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.467 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 1.0 OUTLIER -67.42 -32.41 73.27 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.472 -177.42 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.412 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 31.3 m-80 -77.75 -23.58 49.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.265 0.555 . . . . 0.0 110.276 -178.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 104.26 14.88 23.09 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.512 -178.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -84.76 137.95 32.9 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 174.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.1 p -84.88 153.96 3.58 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-O 121.476 0.655 . . . . 0.0 110.229 177.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 50.0 p90 -160.19 161.65 33.64 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.47 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.704 ' HE1' HE21 ' A' ' 18' ' ' GLN . 12.5 m-85 -119.38 135.99 54.48 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.388 -176.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.527 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.1 121.97 50.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.691 179.871 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.825 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 7.0 t0 -75.1 118.61 18.24 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 171.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.415 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 28.0 m-70 -87.52 -4.22 58.98 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -171.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.4 mt -86.96 -42.79 15.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.947 0.403 . . . . 0.0 110.378 176.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.4 m-80 -101.95 -5.74 24.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.077 179.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.44 58.94 3.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.06 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.825 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 1.3 ptt180 -121.57 121.01 36.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.745 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.527 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -101.78 120.71 40.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.928 -178.813 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.463 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 1.6 t -126.11 137.83 53.63 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.693 0.282 . . . . 0.0 110.486 175.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -89.15 -3.83 58.48 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.21 0.528 . . . . 0.0 109.976 177.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.411 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -106.17 156.85 18.03 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.989 175.887 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.415 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 5.5 t0 -78.13 121.09 83.47 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.213 -175.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.486 ' HA ' ' CD2' ' A' ' 45' ' ' PHE . 1.9 Cg_endo -81.67 53.74 4.78 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.259 2.639 . . . . 0.0 111.969 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.54 -44.8 2.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.524 -177.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.777 ' H ' HD22 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -58.55 -76.94 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.907 0.384 . . . . 0.0 111.992 -175.713 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -102.69 11.53 37.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.038 0.447 . . . . 0.0 111.371 -177.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.486 ' CD2' ' HA ' ' A' ' 41' ' ' PRO . 49.0 m-85 -118.42 133.75 55.62 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.355 -176.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.439 ' HB ' ' H ' ' A' ' 47' ' ' VAL . 3.8 p -107.57 -124.73 0.24 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 172.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.439 ' H ' ' HB ' ' A' ' 46' ' ' THR . 0.8 OUTLIER -95.53 -9.65 9.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 165.578 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -107.68 151.87 25.08 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.019 -178.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -88.86 171.23 10.07 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.348 -174.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -102.17 125.05 37.72 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.917 178.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.84 45.06 1.56 Allowed 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 122.917 2.411 . . . . 0.0 112.786 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.54 HG22 ' HE2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER 54.59 -106.17 0.3 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.584 -179.522 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.54 ' HE2' HG22 ' A' ' 52' ' ' THR . 0.0 OUTLIER -169.25 165.55 6.51 Favored Pre-proline 0 C--N 1.328 -0.357 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 -179.106 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo . . . . . 0 C--O 1.249 1.068 0 C-N-CA 122.148 1.898 . . . . 0.0 112.168 176.069 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.828 0 N-CA-C 112.105 -0.398 . . . . 0.0 112.105 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.8 106.71 12.02 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 179.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.65 59.55 3.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.34 0.591 . . . . 0.0 111.041 -179.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.63 122.5 11.98 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.373 178.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.499 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 1.8 ttm105 -61.25 126.22 26.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.462 -177.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.757 ' HB3' HG23 ' A' ' 8' ' ' VAL . 18.6 mtmt 74.27 -26.8 0.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.804 0.69 . . . . 0.0 111.591 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.44 ' H ' ' C ' ' A' ' 5' ' ' ARG . 5.1 ttp180 61.98 23.98 14.21 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.1 0.56 . . . . 0.0 111.006 -178.176 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.757 HG23 ' HB3' ' A' ' 6' ' ' LYS . 85.2 t -82.13 98.38 4.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.222 0.534 . . . . 0.0 110.353 -179.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -95.26 -23.39 17.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.655 177.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.56 112.08 3.3 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.599 -177.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -53.48 145.21 15.2 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 121.881 0.848 . . . . 0.0 111.725 -177.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.508 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 35.3 mt -76.7 157.31 82.2 Favored Pre-proline 0 C--N 1.307 -1.256 0 CA-C-N 114.281 -1.327 . . . . 0.0 112.087 -173.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.511 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 31.3 Cg_exo -61.09 -172.47 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 123.357 2.704 . . . . 0.0 113.336 176.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -54.56 45.68 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.416 -172.366 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -78.23 -17.26 78.39 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.615 -0.721 . . . . 0.0 113.315 -173.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.575 ' CZ3' HG22 ' A' ' 37' ' ' THR . 92.6 m95 -85.35 133.65 34.13 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.514 0.673 . . . . 0.0 112.735 -170.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -120.42 135.9 54.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.578 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -85.12 109.44 18.26 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.616 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.1 mm-40 -118.35 166.99 11.98 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.421 -176.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.8 m -127.69 135.38 50.11 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.87 173.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.73 -178.23 5.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.369 0.604 . . . . 0.0 110.917 -177.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -32.08 73.38 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.309 -175.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -74.29 -41.66 60.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.436 0.636 . . . . 0.0 110.303 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 125.91 14.05 3.18 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.713 -179.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.39 127.5 34.39 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 175.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -79.17 151.69 4.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.348 0.594 . . . . 0.0 110.228 178.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.405 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.5 p90 -162.09 160.61 27.57 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.518 -178.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.413 ' CD1' HD11 ' A' ' 12' ' ' LEU . 3.2 m-85 -115.25 135.62 53.96 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.828 -179.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.616 ' CG1' ' HG3' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -125.68 129.29 72.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.424 0.63 . . . . 0.0 110.981 177.729 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.522 ' HB3' ' CG ' ' A' ' 35' ' ' ARG . 5.2 t0 -77.76 109.76 12.03 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.638 -1.165 . . . . 0.0 108.404 174.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -85.35 9.24 16.01 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.457 -174.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -94.76 -52.63 9.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.902 0.382 . . . . 0.0 110.082 174.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -103.55 -1.43 28.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.233 -178.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.8 mmtp 63.87 61.17 0.98 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.125 0.57 . . . . 0.0 111.981 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.522 ' CG ' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -123.97 135.93 53.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.896 176.886 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -107.13 123.68 48.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.006 -179.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.575 HG22 ' CZ3' ' A' ' 16' ' ' TRP . 6.8 t -126.53 135.77 51.72 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.943 0.401 . . . . 0.0 110.512 173.122 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -88.55 -1.52 58.1 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.99 0.424 . . . . 0.0 110.512 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.687 HD13 ' H ' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -122.42 165.64 16.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.142 178.326 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.687 ' H ' HD13 ' A' ' 39' ' ' LEU . 8.3 t70 -64.65 130.05 94.57 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.741 -179.053 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.499 ' HD3' ' HA ' ' A' ' 40' ' ' ASP . 2.3 Cg_endo -82.95 3.77 7.59 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.252 2.635 . . . . 0.0 114.726 -172.335 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.8 mtt85 -80.46 -11.03 59.73 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.904 -0.497 . . . . 0.0 111.265 -177.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 mt -86.08 -88.54 0.12 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.383 -177.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -105.99 8.39 32.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.76 0.314 . . . . 0.0 111.692 -174.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.496 ' CD2' ' HA ' ' A' ' 41' ' ' PRO . 13.5 m-85 -112.7 21.22 15.79 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.42 0.628 . . . . 0.0 110.866 -174.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.95 -45.96 3.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.807 177.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.4 p -118.02 127.2 75.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.231 178.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.8 t0 73.55 -39.67 0.44 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.863 0.865 . . . . 0.0 111.947 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.443 ' OD2' ' HD2' ' A' ' 51' ' ' PRO . 4.1 t70 68.41 -167.24 0.19 Allowed 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.815 0.446 . . . . 0.0 111.207 176.447 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.66 ' HB3' ' HD3' ' A' ' 51' ' ' PRO . 4.5 t-20 -152.68 -55.25 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.658 -178.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.66 ' HD3' ' HB3' ' A' ' 50' ' ' ASN . 47.0 Cg_exo -58.61 -38.83 87.59 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 121.878 1.719 . . . . 0.0 111.142 171.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.58 46.97 0.92 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.492 178.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.613 ' N ' ' HD2' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -73.61 -45.49 7.31 Favored Pre-proline 0 CA--C 1.537 0.472 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.862 177.424 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.613 ' HD2' ' N ' ' A' ' 53' ' ' LYS . 12.2 Cg_endo . . . . . 0 C--O 1.252 1.186 0 C-N-CA 121.981 1.787 . . . . 0.0 112.065 177.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.662 0 N-CA-C 111.681 -0.568 . . . . 0.0 111.681 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.21 -40.92 86.51 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.742 0.306 . . . . 0.0 111.635 -177.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -151.55 84.46 1.3 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.86 0.362 . . . . 0.0 111.301 -176.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -83.98 37.79 0.62 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.189 0.518 . . . . 0.0 110.533 177.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -127.76 -150.13 0.43 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.023 -177.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 66.28 51.66 1.2 Allowed 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.196 0.522 . . . . 0.0 111.683 176.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.477 ' HB3' ' H ' ' A' ' 8' ' ' VAL . 0.1 OUTLIER -122.35 -95.08 0.49 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 172.098 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.477 ' H ' ' HB3' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -151.67 129.79 2.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.759 176.575 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -142.11 72.33 1.38 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.053 0.454 . . . . 0.0 110.88 179.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -69.36 -47.92 48.36 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 110.784 -0.926 . . . . 0.0 110.784 176.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -106.72 -92.79 0.39 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 172.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.5 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 16.0 mt -103.17 156.36 35.47 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 174.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.54 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 39.6 Cg_exo -59.62 163.37 13.26 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.332 2.021 . . . . 0.0 111.499 169.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -56.42 -38.64 71.84 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -173.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.7 -23.67 76.65 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 121.123 -0.561 . . . . 0.0 113.421 -178.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.571 ' HZ3' HG22 ' A' ' 37' ' ' THR . 87.3 m95 -85.66 129.33 34.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.328 0.585 . . . . 0.0 112.366 -174.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -110.23 139.8 45.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.329 171.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -95.22 107.83 19.94 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.584 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.5 mm-40 -113.47 167.79 10.29 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.932 -174.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.4 m -116.23 140.07 49.69 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 177.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -179.04 7.24 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.026 0.441 . . . . 0.0 110.727 -179.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.459 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -61.74 -32.83 73.1 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.718 -177.36 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -82.53 -43.8 16.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.781 -177.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 136.38 5.81 1.98 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 121.165 -0.541 . . . . 0.0 111.753 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.49 137.8 38.12 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 176.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.5 p -88.92 152.2 3.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.419 0.628 . . . . 0.0 110.642 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.519 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 45.5 p90 -154.53 161.92 41.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.79 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.449 ' CD2' ' HD3' ' A' ' 41' ' ' PRO . 13.0 m-85 -115.64 133.06 56.4 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.862 -176.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.604 ' HA ' ' O ' ' A' ' 35' ' ' ARG . 0.1 OUTLIER -131.42 119.92 44.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.316 0.579 . . . . 0.0 111.234 179.792 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.615 ' HB3' ' HG3' ' A' ' 35' ' ' ARG . 5.6 t0 -78.03 110.37 12.91 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 171.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -81.67 -8.12 59.67 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.035 -173.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.6 mm -77.96 -55.96 8.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.249 178.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -99.03 -0.03 42.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.357 -177.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? 68.6 60.46 0.37 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.861 173.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.615 ' HG3' ' HB3' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -122.71 119.79 31.73 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.286 177.902 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.559 ' CG2' ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -107.75 112.79 25.64 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.055 177.389 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.571 HG22 ' HZ3' ' A' ' 16' ' ' TRP . 3.4 t -126.24 130.89 51.81 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.064 0.459 . . . . 0.0 110.908 179.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -82.34 -10.4 59.1 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.591 179.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.17 162.42 14.96 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.061 178.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.499 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 10.4 t0 -63.81 123.16 80.69 Favored Pre-proline 0 C--N 1.324 -0.538 0 O-C-N 123.635 0.584 . . . . 0.0 110.94 -176.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.499 ' HD3' ' HA ' ' A' ' 40' ' ' ASP . 23.3 Cg_exo -64.52 -22.31 65.29 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 123.371 2.714 . . . . 0.0 113.325 -175.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 42' ' ' ARG . 0.2 OUTLIER -79.56 -7.31 58.41 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.566 0.21 . . . . 0.0 111.566 -174.493 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.87 -93.87 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.027 0.442 . . . . 0.0 112.07 -178.035 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -105.85 1.38 26.8 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -174.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.418 ' CD2' ' HA ' ' A' ' 41' ' ' PRO . 9.1 m-85 -97.02 -17.82 19.79 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.356 -172.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.4 167.67 10.69 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.062 179.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 16.2 m -96.32 -14.28 7.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 171.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.1 t70 57.56 -157.71 0.29 Allowed 'General case' 0 C--O 1.233 0.228 0 CA-C-N 114.605 -1.18 . . . . 0.0 111.787 178.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -133.9 -18.31 2.11 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.047 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -113.55 115.77 46.54 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.971 178.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -78.11 157.58 30.29 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 122.511 2.141 . . . . 0.0 112.538 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -72.62 0.23 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.909 176.282 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.732 ' HB2' ' HD3' ' A' ' 54' ' ' PRO . 19.2 mmtp -140.82 -51.23 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.406 175.229 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.732 ' HD3' ' HB2' ' A' ' 53' ' ' LYS . 5.0 Cg_exo . . . . . 0 C--O 1.248 0.991 0 C-N-CA 122.39 2.06 . . . . 0.0 111.217 171.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.683 0 N-CA-C 111.785 -0.526 . . . . 0.0 111.785 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -146.61 154.03 41.02 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 -178.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -77.36 143.68 38.54 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 177.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.37 -66.32 1.09 Allowed 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.494 -175.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.84 98.15 1.2 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -174.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -107.26 111.36 23.7 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 170.727 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.81 62.24 6.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.309 -175.542 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.2 t -102.19 -74.56 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.243 -0.435 . . . . 0.0 109.936 177.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -116.89 123.63 47.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.725 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.28 54.87 3.03 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.887 -0.673 . . . . 0.0 113.033 177.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -71.31 -49.8 38.99 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 174.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.423 ' HA ' ' NH1' ' A' ' 42' ' ' ARG . 0.8 OUTLIER -81.16 170.69 14.48 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.415 175.44 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.575 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 51.3 Cg_exo -56.8 165.67 4.6 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.247 1.965 . . . . 0.0 111.278 170.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -61.58 -38.28 86.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.658 -171.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.63 -25.19 75.79 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.161 -0.542 . . . . 0.0 113.548 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.575 ' HD1' ' HB2' ' A' ' 13' ' ' PRO . 86.3 m95 -83.78 144.14 29.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.515 0.674 . . . . 0.0 112.676 -174.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.54 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 2.0 mt-10 -127.29 149.31 50.08 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.095 174.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.633 HE21 ' HE1' ' A' ' 28' ' ' PHE . 35.5 tt0 -96.88 102.89 14.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.697 177.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.507 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.6 mt-10 -105.48 178.86 4.44 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.989 0.423 . . . . 0.0 110.424 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.8 m -131.5 139.58 49.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.325 176.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.401 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -78.52 176.64 9.22 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.338 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.477 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 2.4 pt-20 -67.29 -26.34 66.49 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.771 -174.163 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.401 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 35.6 m-80 -84.9 -35.11 22.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.963 0.411 . . . . 0.0 110.219 -179.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 126.15 15.09 2.87 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.216 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -83.52 142.52 30.84 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 174.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -90.97 154.94 3.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.303 0.573 . . . . 0.0 110.507 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.438 ' CB ' ' HA ' ' A' ' 38' ' ' TYR . 50.6 p90 -161.96 161.08 28.47 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.264 178.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.633 ' HE1' HE21 ' A' ' 18' ' ' GLN . 14.0 m-85 -116.88 139.96 50.01 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.045 -176.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.547 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.77 123.68 52.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.218 0.532 . . . . 0.0 111.515 -177.916 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -73.03 114.62 11.39 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 170.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.54 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 50.3 m-70 -84.98 -4.13 59.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.789 0.328 . . . . 0.0 111.375 -175.406 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.5 mm -95.97 -49.78 12.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.4 0.619 . . . . 0.0 109.952 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -98.43 -5.89 31.6 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.04 -177.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.16 56.32 1.77 Allowed 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 175.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.516 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -119.13 120.68 37.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.738 177.896 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.547 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.1 OUTLIER -105.0 116.2 31.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.312 179.331 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.413 HG22 ' CZ3' ' A' ' 16' ' ' TRP . 1.2 t -126.05 132.29 51.99 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.673 0.273 . . . . 0.0 110.429 177.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.438 ' HA ' ' CB ' ' A' ' 27' ' ' PHE . 8.2 m-85 -72.87 -25.52 61.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.019 0.438 . . . . 0.0 111.104 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.777 ' HB3' ' HE2' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -106.33 170.4 7.95 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.629 178.513 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -74.71 120.66 82.63 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.594 -175.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.743 ' HA ' ' HB2' ' A' ' 45' ' ' PHE . 45.0 Cg_endo -75.02 3.68 5.41 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 122.802 2.335 . . . . 0.0 113.349 -176.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.423 ' NH1' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -84.87 -6.74 59.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.798 0.333 . . . . 0.0 110.883 178.424 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 69.9 mt -91.85 -101.9 0.11 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.112 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -97.49 4.64 50.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.87 0.366 . . . . 0.0 111.855 -175.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.777 ' HE2' ' HB3' ' A' ' 39' ' ' LEU . 25.5 m-85 -100.44 -0.54 37.88 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.414 -175.379 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.99 144.5 26.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.957 -179.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 12.6 t -68.3 97.65 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.437 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.23 -55.15 0.31 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.499 -0.773 . . . . 0.0 108.928 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -98.34 171.77 7.98 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 168.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -87.58 116.57 66.57 Favored Pre-proline 0 C--N 1.313 -0.991 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 176.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -48.76 118.93 3.76 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.994 2.463 . . . . 0.0 112.489 -176.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.1 41.45 0.52 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.216 0.531 . . . . 0.0 111.55 -177.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt -134.63 81.23 48.35 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 176.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo . . . . . 0 C--O 1.251 1.148 0 C-N-CA 123.221 2.614 . . . . 0.0 112.568 -173.704 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.812 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -131.48 -62.65 0.87 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.621 0.248 . . . . 0.0 110.78 -177.053 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -73.8 123.24 23.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.982 -178.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.59 136.2 36.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.041 -178.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.62 63.4 1.6 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.363 176.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER 50.24 54.46 11.08 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.545 -174.111 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.9 mtm-85 -83.65 68.07 9.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.736 -170.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 33.0 m -81.53 -18.31 11.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 170.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 65.79 55.74 0.95 Allowed 'General case' 0 C--O 1.234 0.259 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.923 174.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.18 82.39 1.67 Allowed Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 110.103 -1.199 . . . . 0.0 110.103 170.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.12 -171.94 1.87 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.326 0.584 . . . . 0.0 111.351 -171.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.617 ' HB3' ' HB2' ' A' ' 16' ' ' TRP . 15.9 mt -86.33 151.09 53.17 Favored Pre-proline 0 C--N 1.317 -0.808 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.463 -174.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.451 ' HB2' ' HD1' ' A' ' 16' ' ' TRP . 46.4 Cg_exo -59.25 175.82 0.65 Allowed 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.382 2.722 . . . . 0.0 111.704 170.248 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -64.53 -40.1 94.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.258 -173.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.1 -29.28 73.32 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.828 -0.701 . . . . 0.0 113.021 -178.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.617 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 92.0 m95 -82.44 132.5 35.21 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -173.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.407 ' HB2' ' CD2' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -115.31 142.24 46.95 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.852 174.758 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.831 HE21 ' HE1' ' A' ' 28' ' ' PHE . 34.2 tt0 -91.22 102.77 15.49 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 176.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.665 ' HG3' ' CG1' ' A' ' 29' ' ' VAL . 1.6 mm-40 -110.57 168.82 9.18 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.296 0.57 . . . . 0.0 111.069 -175.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.1 m -122.99 135.15 54.36 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.661 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.52 ' CG ' ' H ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -83.07 -179.1 7.34 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.415 179.567 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.472 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 1.6 pt-20 -72.61 -15.98 61.73 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.515 -175.001 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.52 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 38.5 m-80 -88.31 -10.66 48.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.909 0.385 . . . . 0.0 110.314 177.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.17 17.22 57.94 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.787 -177.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -91.92 144.56 25.34 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -88.15 156.24 3.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.349 0.595 . . . . 0.0 110.81 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.453 ' CZ ' ' HB2' ' A' ' 19' ' ' GLU . 47.5 p90 -162.21 160.61 27.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.096 177.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.831 ' HE1' HE21 ' A' ' 18' ' ' GLN . 13.8 m-85 -116.82 135.28 53.86 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.219 -176.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.824 ' HB ' HG23 ' A' ' 36' ' ' THR . 0.2 OUTLIER -131.4 124.09 54.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 120.904 0.383 . . . . 0.0 110.825 179.704 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.546 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 1.4 t0 -76.78 131.64 38.82 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 170.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.407 ' CD2' ' HB2' ' A' ' 17' ' ' GLU . 70.8 m-70 -97.9 -0.75 44.37 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 121.003 -0.279 . . . . 0.0 111.651 -172.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.8 mt -92.58 -55.29 6.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.896 177.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -95.53 -14.96 23.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.748 0.308 . . . . 0.0 110.18 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 30' ' ' ASP . 2.0 mmtt 70.58 71.76 0.2 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.98 176.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.578 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.6 mtp180 -122.38 119.12 30.1 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.24 174.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.824 HG23 ' HB ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER -104.01 114.09 28.09 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.469 178.833 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.31 138.59 53.08 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.666 0.269 . . . . 0.0 111.134 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -78.42 -14.65 59.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.848 0.356 . . . . 0.0 110.857 175.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.503 HD22 ' HA ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -102.86 155.57 18.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.497 -178.386 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.507 ' OD2' ' HG ' ' A' ' 43' ' ' LEU . 5.2 t0 -73.02 121.87 86.21 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.199 -175.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.512 ' HA ' ' HB2' ' A' ' 45' ' ' PHE . 17.0 Cg_exo -67.77 -8.93 23.91 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 123.327 2.685 . . . . 0.0 112.817 -179.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.647 ' HA ' HH11 ' A' ' 42' ' ' ARG . 0.0 OUTLIER -90.82 -11.27 39.88 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.909 178.594 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.507 ' HG ' ' OD2' ' A' ' 40' ' ' ASP . 67.1 mt -82.61 -91.16 0.07 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.706 0.288 . . . . 0.0 111.466 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -105.55 13.23 30.32 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -173.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.512 ' HB2' ' HA ' ' A' ' 41' ' ' PRO . 43.7 m-85 -94.42 24.52 4.45 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.308 0.575 . . . . 0.0 110.599 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -46.64 72.29 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.581 176.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.59 140.68 28.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.202 179.039 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -73.0 90.96 1.52 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.798 177.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.6 t70 59.3 -113.22 0.64 Allowed 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.737 -175.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -164.79 125.81 1.4 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-O 120.583 0.23 . . . . 0.0 110.679 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -73.34 -13.32 25.43 Favored 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 122.786 2.324 . . . . 0.0 112.453 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.5 m -81.21 72.69 8.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.19 0.519 . . . . 0.0 110.522 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.8 mtmt -160.5 154.69 19.67 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.407 179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo . . . . . 0 C--O 1.25 1.075 0 C-N-CA 122.492 2.128 . . . . 0.0 111.994 176.466 . . . . . . . . 0 0 . 1 stop_ save_